A0A096MAK0_POEFO Loading...

Androgen induced 1

AlphaFold DB (A0A3B3UWQ7), UniProt , Accession A0A096MAK0, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 233 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M37.5Very low79.1Confident230 Ų23089.9 Ų89.9100%1.13351%0.513SS*.  0118.70-113.3177.5-85.500107.1L3M1-L3 PolarHBondContact O-N 2.97Å
2A42.8Very low80.6Confident106 Ų10686.8 Ų86.888%0.87651%0.507SS*.  trans-66.410417700000108.5I4A2-I4 PolarHBondContact O-N 3.41Å
3L67.7Low81.8Confident160 Ų16080.6 Ų80.684%0.83847%0.47SS*.PPolyproline II helixtrans-63.7122171.7-106.986.4000107.5M1M1-L3 PolarHBondContact O-N 2.97Å
4I73.9Confident83Confident114 Ų11476.1 Ų76.159%0.58544%0.443SS*.PPolyproline II helixtrans-57.4129.8169.8-62.6171.4000107.4A2 S6 V8A2-I4 PolarHBondContact O-N 3.41Å; I4-S6 PolarHBondContact O-N 3.08Å; I4-V8 HydrophobicContact CG2-CB 4Å; I4-V8 HydrophobicContact CG2-CG1 4.07Å
5P86.8Confident84Confident70 Ų7078.1 Ų78.146%0.45545%0.451SS..PPolyproline II helixtrans-57.3135.5177.1-23.432.8000110.7Q7 V8 L9P5-Q7 PolarHBondContact O-N 3.14Å; P5-Q7 VanDerWaalsContact O-N 3.07Å; P5-V8 HydrophobicContact CB-CG2 4.18Å; P5-V8 HydrophobicContact CG-CG2 4.25Å; P5-V8 WeakPolarHBondContact O-CB 3.4Å; P5-V8 PolarHBondContact O-N 3.02Å; P5-L9 PolarHBondContact O-N 3.02Å
6S88.5Confident84.8Confident40 Ų4075.4 Ų75.428%0.2844%0.438SS..Hα-helixtrans-54.1-32.3-179.353.60000112.9I4 L9 R10I4-S6 PolarHBondContact O-N 3.08Å; S6-L9 WeakPolarHBondContact O-CB 3.36Å; S6-L9 PolarHBondContact O-N 3.49Å; S6-R10 WeakPolarHBondContact O-CG 3.15Å; S6-R10 PolarHBondContact O-N 3Å
7Q92.2Very high85.6Confident71 Ų7170.9 Ų70.933%0.33241%0.412SS..Hα-helixtrans-60.9-45.6175.5-60.8155.4-42.500112.1P5 L9 R10 V11 D61P5-Q7 PolarHBondContact O-N 3.14Å; P5-Q7 VanDerWaalsContact O-N 3.07Å; Q7-L9 VanDerWaalsContact C-N 3.31Å; Q7-L9 PolarHBondContact O-N 2.74Å; Q7-R10 PolarHBondContact O-N 3.19Å; Q7-V11 WeakPolarHBondContact O-CG2 3.45Å; Q7-V11 PolarHBondContact O-N 2.8Å; Q7-V11 VanDerWaalsContact O-N 3.15Å; Q7-D61 HydrophobicContact CG-CB 4.1Å
8V92.9Very high86.2Confident83 Ų8372.8 Ų72.850%0.50341%0.414SS..Hα-helixtrans-66-39.6178.5177.20000110.1I4 P5 V11 A12I4-V8 HydrophobicContact CG2-CB 4Å; I4-V8 HydrophobicContact CG2-CG1 4.07Å; P5-V8 HydrophobicContact CB-CG2 4.18Å; P5-V8 HydrophobicContact CG-CG2 4.25Å; P5-V8 WeakPolarHBondContact O-CB 3.4Å; P5-V8 PolarHBondContact O-N 3.02Å; V8-V11 PolarHBondContact O-N 3.21Å; V8-A12 WeakPolarHBondContact O-CB 3.39Å; V8-A12 PolarHBondContact O-N 3.34Å
9L94.2Very high86.8Confident46 Ų4671.7 Ų71.724%0.24141%0.412CS..Hα-helixtrans-63.4-45.3178.5-17555.6000112.1P5 S6 Q7 V11 A12 I13 I143 T147P5-L9 PolarHBondContact O-N 3.02Å; S6-L9 WeakPolarHBondContact O-CB 3.36Å; S6-L9 PolarHBondContact O-N 3.49Å; Q7-L9 VanDerWaalsContact C-N 3.31Å; Q7-L9 PolarHBondContact O-N 2.74Å; L9-V11 PolarHBondContact O-N 2.99Å; L9-A12 PolarHBondContact O-N 2.99Å; L9-I13 HydrophobicContact CD1-CD1 4.1Å; L9-I13 HydrophobicContact CD1-CG1 4.41Å; L9-I13 HydrophobicContact CG-CD1 3.98Å; L9-I13 WeakPolarHBondContact O-CB 3.45Å; L9-I13 VanDerWaalsContact O-CG1 3.26Å; L9-I13 WeakPolarHBondContact O-CG1 3.42Å; L9-I13 PolarHBondContact O-N 2.98Å; L9-I143 HydrophobicContact CD1-CG2 4.34Å; L9-I143 HydrophobicContact CD2-CG2 3.17Å; L9-I143 HydrophobicContact CG-CG2 3.87Å; L9-T147 HydrophobicContact CD2-CG2 4.31Å
10R96.1Very high87.3Confident6 Ų668.7 Ų68.72%0.02339%0.394CS..Hα-helixtrans-61.6-42.2175.9-73.8162.6172.4159.6-3.1112.8S6 Q7 I13 L14 F54 C57 V58 D61 E144 T148S6-R10 WeakPolarHBondContact O-CG 3.15Å; S6-R10 PolarHBondContact O-N 3Å; Q7-R10 PolarHBondContact O-N 3.19Å; R10-I13 PolarHBondContact O-N 3.34Å; R10-L14 VanDerWaalsContact O-CB 3.31Å; R10-L14 WeakPolarHBondContact O-CB 3.4Å; R10-L14 PolarHBondContact O-N 3.38Å; R10-F54 HydrophobicContact CB-CD1 4.47Å; R10-F54 HydrophobicContact CG-CD1 4.31Å; R10-C57 HydrophobicContact CG-CB 4.27Å; R10-V58 HydrophobicContact CB-CG2 3.96Å; R10-D61 WeakPolarHBondContact CD-OD2 3.42Å; R10-D61 IonicContact CZ-OD1 2.9Å; R10-D61 IonicContact CZ-OD2 2.8Å; R10-D61 IonicContact NE-OD2 2.84Å; R10-D61 IonicContact NH1-OD1 3.43Å; R10-D61 PolarHBondContact NH1-OD1 3.02Å; R10-D61 IonicContact NH1-OD2 3.62Å; R10-D61 PolarHBondContact NH1-OD2 2.94Å; R10-E144 WeakPolarHBondContact CG-OE2 3.43Å; R10-E144 IonicContact CZ-OE1 3.99Å; R10-E144 IonicContact CZ-OE2 3.71Å; R10-E144 IonicContact NE-OE1 3.74Å; R10-E144 PolarHBondContact NE-OE1 3.5Å; R10-E144 IonicContact NE-OE2 3.87Å; R10-E144 PolarHBondContact NE-OE2 3.47Å; R10-E144 IonicContact NH2-OE1 2.86Å; R10-E144 PolarHBondContact NH2-OE1 3.42Å; R10-E144 IonicContact NH2-OE2 3.82Å; R10-T148 PolarHBondContact NH2-OG1 3.44Å
11V97.1Very high87.7Confident63 Ų6366.5 Ų66.538%0.38238%0.381SS..Hα-helixtrans-63-46.1175.5172.80000110.4Q7 V8 L9 I13 L14 L15 V58Q7-V11 WeakPolarHBondContact O-CG2 3.45Å; Q7-V11 PolarHBondContact O-N 2.8Å; Q7-V11 VanDerWaalsContact O-N 3.15Å; V8-V11 PolarHBondContact O-N 3.21Å; L9-V11 PolarHBondContact O-N 2.99Å; V11-I13 PolarHBondContact O-N 2.85Å; V11-L14 PolarHBondContact O-N 3.35Å; V11-L15 HydrophobicContact CG1-CD1 4.06Å; V11-L15 HydrophobicContact CG1-CG 4.4Å; V11-L15 VanDerWaalsContact O-CG 3.31Å; V11-L15 WeakPolarHBondContact O-CG 3.34Å; V11-L15 PolarHBondContact O-N 3.39Å; V11-V58 HydrophobicContact CG2-CG1 4.03Å; V11-V58 HydrophobicContact CG2-CG2 3.8Å
12A97.1Very high90.5Very high53 Ų5359.7 Ų59.744%0.43836%0.355SS..Hα-helixtrans-61-43.6177.800000112.1V8 L9 L15 S16V8-A12 WeakPolarHBondContact O-CB 3.39Å; V8-A12 PolarHBondContact O-N 3.34Å; L9-A12 PolarHBondContact O-N 2.99Å; A12-L15 PolarHBondContact O-N 3.1Å; A12-S16 PolarHBondContact O-N 3.08Å
13I97.2Very high93Very high6 Ų659 Ų593%0.03133%0.333CS..Hα-helixtrans-63.1-45.8175.9-68.9166.7000110.6L9 R10 V11 L15 S16 Y17 F54 F140 I143L9-I13 HydrophobicContact CD1-CD1 4.1Å; L9-I13 HydrophobicContact CD1-CG1 4.41Å; L9-I13 HydrophobicContact CG-CD1 3.98Å; L9-I13 WeakPolarHBondContact O-CB 3.45Å; L9-I13 VanDerWaalsContact O-CG1 3.26Å; L9-I13 WeakPolarHBondContact O-CG1 3.42Å; L9-I13 PolarHBondContact O-N 2.98Å; R10-I13 PolarHBondContact O-N 3.34Å; V11-I13 PolarHBondContact O-N 2.85Å; I13-L15 PolarHBondContact O-N 3.05Å; I13-S16 WeakPolarHBondContact O-CB 3.37Å; I13-S16 PolarHBondContact O-N 3.22Å; I13-S16 VanDerWaalsContact O-N 3.1Å; I13-S16 PolarHBondContact O-OG 3.45Å; I13-Y17 HydrophobicContact CG2-CD2 3.76Å; I13-Y17 HydrophobicContact CG2-CE2 3.45Å; I13-Y17 VanDerWaalsContact CG2-CE2 3.45Å; I13-Y17 WeakPolarHBondContact O-CD2 3.17Å; I13-Y17 PolarHBondContact O-N 3.2Å; I13-F54 HydrophobicContact CB-CD1 4.14Å; I13-F54 HydrophobicContact CB-CE1 4.15Å; I13-F54 HydrophobicContact CB-CG 4.49Å; I13-F54 HydrophobicContact CD1-CE1 3.84Å; I13-F54 HydrophobicContact CD1-CZ 4.14Å; I13-F54 HydrophobicContact CG2-CD1 3.75Å; I13-F54 HydrophobicContact CG2-CD2 3.67Å; I13-F54 HydrophobicContact CG2-CE1 3.71Å; I13-F54 HydrophobicContact CG2-CE2 3.64Å; I13-F54 HydrophobicContact CG2-CG 3.74Å; I13-F54 HydrophobicContact CG2-CZ 3.66Å; I13-F140 HydrophobicContact CD1-CB 4.22Å; I13-F140 HydrophobicContact CD1-CD1 4.32Å; I13-F140 HydrophobicContact CD1-CG 4.31Å; I13-F140 HydrophobicContact CG1-CB 4.45Å; I13-F140 HydrophobicContact CG1-CD1 4.08Å; I13-F140 HydrophobicContact CG1-CD2 4.43Å; I13-F140 HydrophobicContact CG1-CE1 4.43Å; I13-F140 HydrophobicContact CG1-CG 4.08Å; I13-F140 HydrophobicContact CG2-CB 3.99Å; I13-F140 HydrophobicContact CG2-CD2 3.73Å; I13-F140 HydrophobicContact CG2-CE2 4.38Å; I13-F140 HydrophobicContact CG2-CG 3.93Å; I13-I143 HydrophobicContact CD1-CG2 4.36Å
14L98Very high94.2Very high18 Ų1852 Ų529%0.09430%0.296CS..Hα-helixtrans-58.9-46177.7179.459.1000111.9R10 V11 S16 Y17 F18 A51 F54 V58R10-L14 VanDerWaalsContact O-CB 3.31Å; R10-L14 WeakPolarHBondContact O-CB 3.4Å; R10-L14 PolarHBondContact O-N 3.38Å; V11-L14 PolarHBondContact O-N 3.35Å; L14-S16 VanDerWaalsContact C-N 3.27Å; L14-S16 PolarHBondContact O-N 2.88Å; L14-Y17 PolarHBondContact O-N 2.87Å; L14-F18 HydrophobicContact CD1-CD2 4.33Å; L14-F18 HydrophobicContact CD1-CE1 4.38Å; L14-F18 HydrophobicContact CD1-CE2 3.76Å; L14-F18 HydrophobicContact CD1-CZ 3.79Å; L14-F18 HydrophobicContact CD2-CE2 4.07Å; L14-F18 HydrophobicContact CG-CD2 4.11Å; L14-F18 HydrophobicContact CG-CE2 3.63Å; L14-F18 HydrophobicContact CG-CZ 4.17Å; L14-F18 PolarHBondContact O-N 3.26Å; L14-A51 VanDerWaalsContact CD1-O 3.24Å; L14-A51 WeakPolarHBondContact CD1-O 3.37Å; L14-F54 HydrophobicContact CB-CB 4.18Å; L14-F54 HydrophobicContact CD1-CB 4.22Å; L14-V58 HydrophobicContact CD2-CB 4.25Å; L14-V58 HydrophobicContact CD2-CG2 3.94Å
15L97.8Very high95Very high106 Ų10651.5 Ų51.556%0.55529%0.29SS*.Hα-helixtrans-62.4-36.1175.8-69.2175.7000111.8V11 A12 I13 F18 S19V11-L15 HydrophobicContact CG1-CD1 4.06Å; V11-L15 HydrophobicContact CG1-CG 4.4Å; V11-L15 VanDerWaalsContact O-CG 3.31Å; V11-L15 WeakPolarHBondContact O-CG 3.34Å; V11-L15 PolarHBondContact O-N 3.39Å; A12-L15 PolarHBondContact O-N 3.1Å; I13-L15 PolarHBondContact O-N 3.05Å; L15-F18 PolarHBondContact O-N 3.42Å; L15-S19 WeakPolarHBondContact O-CB 3.47Å; L15-S19 PolarHBondContact O-N 3.02Å
16S97.1Very high95.2Very high34 Ų3452 Ų5224%0.23830%0.3CS..Hα-helixtrans-63.5-41.9174.782.60000112A12 I13 L14 S19 I20 F140A12-S16 PolarHBondContact O-N 3.08Å; I13-S16 WeakPolarHBondContact O-CB 3.37Å; I13-S16 PolarHBondContact O-N 3.22Å; I13-S16 VanDerWaalsContact O-N 3.1Å; I13-S16 PolarHBondContact O-OG 3.45Å; L14-S16 VanDerWaalsContact C-N 3.27Å; L14-S16 PolarHBondContact O-N 2.88Å; S16-S19 WeakPolarHBondContact O-CB 3.42Å; S16-S19 PolarHBondContact O-N 2.92Å; S16-I20 WeakPolarHBondContact O-CD1 3.27Å; S16-I20 WeakPolarHBondContact O-CG1 3.11Å; S16-I20 PolarHBondContact O-N 3.3Å; S16-F140 VanDerWaalsContact OG-CE2 3.24Å; S16-F140 WeakPolarHBondContact OG-CE2 3.25Å
17Y97.8Very high95.2Very high0 Ų052 Ų520%030%0.296CS..Hα-helixtrans-66.4-40.2175.8-78.2-59.8000112.3I13 L14 S19 I20 L21 L47 Q50 F54 V137 F140I13-Y17 HydrophobicContact CG2-CD2 3.76Å; I13-Y17 HydrophobicContact CG2-CE2 3.45Å; I13-Y17 VanDerWaalsContact CG2-CE2 3.45Å; I13-Y17 WeakPolarHBondContact O-CD2 3.17Å; I13-Y17 PolarHBondContact O-N 3.2Å; L14-Y17 PolarHBondContact O-N 2.87Å; Y17-S19 VanDerWaalsContact C-N 3.33Å; Y17-S19 PolarHBondContact O-N 3.3Å; Y17-I20 PolarHBondContact O-N 3.05Å; Y17-L21 WeakPolarHBondContact O-CB 3.37Å; Y17-L21 WeakPolarHBondContact O-CG 3.48Å; Y17-L21 PolarHBondContact O-N 3.17Å; Y17-L47 HydrophobicContact CD1-CD2 3.91Å; Y17-L47 HydrophobicContact CE1-CD2 3.88Å; Y17-Q50 HydrophobicContact CD1-CB 4.12Å; Y17-Q50 HydrophobicContact CD2-CB 4.16Å; Y17-Q50 HydrophobicContact CE1-CB 3.63Å; Y17-Q50 HydrophobicContact CE1-CG 4.01Å; Y17-Q50 HydrophobicContact CE2-CB 3.65Å; Y17-Q50 HydrophobicContact CE2-CG 4.48Å; Y17-Q50 HydrophobicContact CG-CB 4.37Å; Y17-Q50 WeakPolarHBondContact OH-CG 3.47Å; Y17-F54 HydrophobicContact CD2-CD2 4.01Å; Y17-F54 AromaticContact CE2-CD2 3.52Å; Y17-F54 HydrophobicContact CE2-CD2 3.52Å; Y17-F54 AromaticContact CE2-CE2 3.72Å; Y17-F54 HydrophobicContact CE2-CE2 3.72Å; Y17-F54 HydrophobicContact CE2-CG 4.49Å; Y17-V137 HydrophobicContact CE1-CG2 4.34Å; Y17-V137 WeakPolarHBondContact OH-CA 3.44Å; Y17-F140 AromaticContact CE2-CD2 3.93Å; Y17-F140 HydrophobicContact CE2-CD2 3.93Å; Y17-F140 AromaticContact CZ-CD2 3.81Å
18F97.6Very high94.8Very high104 Ų10454.3 Ų54.346%0.45631%0.311SS..Hα-helixtrans-61.3-43.1172.5-71.5-38.7000111.7L14 L15 I20 L21 C22L14-F18 HydrophobicContact CD1-CD2 4.33Å; L14-F18 HydrophobicContact CD1-CE1 4.38Å; L14-F18 HydrophobicContact CD1-CE2 3.76Å; L14-F18 HydrophobicContact CD1-CZ 3.79Å; L14-F18 HydrophobicContact CD2-CE2 4.07Å; L14-F18 HydrophobicContact CG-CD2 4.11Å; L14-F18 HydrophobicContact CG-CE2 3.63Å; L14-F18 HydrophobicContact CG-CZ 4.17Å; L14-F18 PolarHBondContact O-N 3.26Å; L15-F18 PolarHBondContact O-N 3.42Å; F18-I20 PolarHBondContact O-N 3.01Å; F18-L21 PolarHBondContact O-N 2.74Å; F18-C22 VanDerWaalsContact O-CB 3.28Å; F18-C22 WeakPolarHBondContact O-CB 3.2Å; F18-C22 PolarHBondContact O-N 2.9Å; F18-C22 PolarHBondContact O-SG 3.12Å
19S96.9Very high94.4Very high53 Ų5350.7 Ų50.737%0.37129%0.289SS..Hα-helixtrans-58.8-47.8175.3-175.90000111.9L15 S16 Y17 C22 H23L15-S19 WeakPolarHBondContact O-CB 3.47Å; L15-S19 PolarHBondContact O-N 3.02Å; S16-S19 WeakPolarHBondContact O-CB 3.42Å; S16-S19 PolarHBondContact O-N 2.92Å; Y17-S19 VanDerWaalsContact C-N 3.33Å; Y17-S19 PolarHBondContact O-N 3.3Å; S19-C22 PolarHBondContact O-N 3.02Å; S19-H23 WeakPolarHBondContact O-CB 3.37Å; S19-H23 PolarHBondContact O-N 3.39Å; S19-H23 PolarHBondContact O-ND1 3.26Å
20I97.1Very high93.8Very high10 Ų1052.4 Ų52.45%0.05130%0.303CS..Hα-helixtrans-60.5-48.7177.6-70.2159.6000110.9S16 Y17 F18 H23 Y24 L47 W128 L129 M133S16-I20 WeakPolarHBondContact O-CD1 3.27Å; S16-I20 WeakPolarHBondContact O-CG1 3.11Å; S16-I20 PolarHBondContact O-N 3.3Å; Y17-I20 PolarHBondContact O-N 3.05Å; F18-I20 PolarHBondContact O-N 3.01Å; I20-H23 PolarHBondContact O-N 2.96Å; I20-Y24 VanDerWaalsContact O-CB 3.26Å; I20-Y24 WeakPolarHBondContact O-CB 3.47Å; I20-Y24 PolarHBondContact O-N 3.05Å; I20-L47 HydrophobicContact CG2-CD1 4.07Å; I20-L47 HydrophobicContact CG2-CD2 4.08Å; I20-W128 HydrophobicContact CG1-CZ3 4.44Å; I20-L129 HydrophobicContact CB-CD1 4.37Å; I20-L129 HydrophobicContact CG2-CD1 3.85Å; I20-M133 HydrophobicContact CG2-CG 3.87Å
21L96.3Very high92.9Very high24 Ų2453.4 Ų53.413%0.12631%0.313CS..Hα-helixtrans-63.5-43.7-179.4-76.5169.1000112.1Y17 F18 Y24 K25 F44 L47 V48 A51Y17-L21 WeakPolarHBondContact O-CB 3.37Å; Y17-L21 WeakPolarHBondContact O-CG 3.48Å; Y17-L21 PolarHBondContact O-N 3.17Å; F18-L21 PolarHBondContact O-N 2.74Å; L21-Y24 PolarHBondContact O-N 3.13Å; L21-K25 WeakPolarHBondContact O-CB 3.35Å; L21-K25 WeakPolarHBondContact O-CG 3.47Å; L21-K25 PolarHBondContact O-N 2.85Å; L21-F44 HydrophobicContact CD2-CD2 4.18Å; L21-F44 HydrophobicContact CD2-CE2 3.65Å; L21-F44 HydrophobicContact CD2-CZ 4.34Å; L21-L47 HydrophobicContact CD2-CB 3.85Å; L21-L47 HydrophobicContact CG-CB 4.43Å; L21-V48 HydrophobicContact CD2-CG2 4.16Å; L21-A51 HydrophobicContact CD1-CB 3.79Å
22C95.6Very high92.2Very high86 Ų8652.1 Ų52.158%0.58130%0.302SS*.Hα-helixtrans-62.7-48.1177.1-74.20000111.3F18 S19 K25 A26F18-C22 VanDerWaalsContact O-CB 3.28Å; F18-C22 WeakPolarHBondContact O-CB 3.2Å; F18-C22 PolarHBondContact O-N 2.9Å; F18-C22 PolarHBondContact O-SG 3.12Å; S19-C22 PolarHBondContact O-N 3.02Å; C22-K25 PolarHBondContact O-N 2.86Å; C22-A26 WeakPolarHBondContact O-CB 3.35Å; C22-A26 PolarHBondContact O-N 3.5Å
23H94.9Very high91.4Very high92 Ų9256.5 Ų56.543%0.42631%0.314SS..Hα-helixtrans-63.2-44.7177.7-77.787.3000111.7S19 I20 K25 A26 L27 W128 L129S19-H23 WeakPolarHBondContact O-CB 3.37Å; S19-H23 PolarHBondContact O-N 3.39Å; S19-H23 PolarHBondContact O-ND1 3.26Å; I20-H23 PolarHBondContact O-N 2.96Å; H23-K25 VanDerWaalsContact C-N 3.32Å; H23-K25 PolarHBondContact O-N 3.12Å; H23-A26 PolarHBondContact O-N 2.96Å; H23-A26 VanDerWaalsContact O-N 3.16Å; H23-L27 WeakPolarHBondContact O-CG 3.37Å; H23-L27 PolarHBondContact O-N 3.49Å; H23-W128 HydrophobicContact CB-CH2 3.67Å; H23-W128 HydrophobicContact CB-CZ2 4.01Å; H23-W128 AromaticContact CD2-CH2 3.9Å; H23-W128 AromaticContact CD2-CZ2 3.67Å; H23-W128 AromaticContact CG-CH2 3.52Å; H23-W128 AromaticContact CG-CZ2 3.76Å; H23-W128 AromaticContact ND1-CH2 3.79Å; H23-L129 HydrophobicContact CB-CD1 4.31Å
24Y93.4Very high90.9Very high13 Ų1359.2 Ų59.25%0.05133%0.33CS..Hα-helixtrans-61.1-40177.6179.3-102.9000112.4I20 L21 A26 L27 M29 H32 F44 M133I20-Y24 VanDerWaalsContact O-CB 3.26Å; I20-Y24 WeakPolarHBondContact O-CB 3.47Å; I20-Y24 PolarHBondContact O-N 3.05Å; L21-Y24 PolarHBondContact O-N 3.13Å; Y24-A26 VanDerWaalsContact C-N 3.34Å; Y24-L27 HydrophobicContact CD2-CD1 4.42Å; Y24-L27 WeakPolarHBondContact O-CB 3.24Å; Y24-L27 PolarHBondContact O-N 2.87Å; Y24-M29 HydrophobicContact CD2-CE 4.33Å; Y24-M29 HydrophobicContact CE2-CE 3.66Å; Y24-H32 AromaticContact CE1-CE1 3.75Å; Y24-H32 AromaticContact CE1-NE2 3.44Å; Y24-H32 WeakPolarHBondContact CE1-NE2 3.28Å; Y24-H32 AromaticContact CE2-NE2 3.82Å; Y24-H32 AromaticContact CZ-CE1 3.74Å; Y24-H32 AromaticContact CZ-NE2 3.15Å; Y24-H32 PolarHBondContact O-CE1 3.26Å; Y24-H32 PolarHBondContact OH-NE2 3.43Å; Y24-F44 AromaticContact CD1-CD2 3.56Å; Y24-F44 HydrophobicContact CD1-CD2 3.56Å; Y24-F44 AromaticContact CD1-CE2 3.88Å; Y24-F44 HydrophobicContact CD1-CE2 3.88Å; Y24-F44 HydrophobicContact CE1-CB 4.34Å; Y24-F44 AromaticContact CE1-CD2 3.38Å; Y24-F44 HydrophobicContact CE1-CD2 3.38Å; Y24-F44 HydrophobicContact CE1-CE2 4.02Å; Y24-F44 HydrophobicContact CE1-CG 4.1Å; Y24-M133 HydrophobicContact CD2-CE 4.32Å; Y24-M133 HydrophobicContact CD2-SD 3.38Å; Y24-M133 WeakPolarHBondContact CD2-SD 3.42Å; Y24-M133 HydrophobicContact CE2-SD 3.8Å; Y24-M133 HydrophobicContact CG-SD 4.06Å
25K90.2Very high90.4Very high103 Ų10363.4 Ų63.445%0.44835%0.346SS..Hα-helixtrans-72.5-25.2176-77.2-68.5-173.5-178.70113.9L21 C22 H23 L27 S38 F44L21-K25 WeakPolarHBondContact O-CB 3.35Å; L21-K25 WeakPolarHBondContact O-CG 3.47Å; L21-K25 PolarHBondContact O-N 2.85Å; C22-K25 PolarHBondContact O-N 2.86Å; H23-K25 VanDerWaalsContact C-N 3.32Å; H23-K25 PolarHBondContact O-N 3.12Å; K25-L27 VanDerWaalsContact C-N 3.27Å; K25-S38 PolarHBondContact NZ-OG 2.93Å; K25-F44 HydrophobicContact CD-CE2 4.44Å; K25-F44 HydrophobicContact CG-CE2 4.48Å
26A90.9Very high90Very high82 Ų8259.4 Ų59.468%0.67833%0.33SS*.Hα-helixtrans-77.2-13.8175.300000112.8C22 H23 Y24 D28C22-A26 WeakPolarHBondContact O-CB 3.35Å; C22-A26 PolarHBondContact O-N 3.5Å; H23-A26 PolarHBondContact O-N 2.96Å; H23-A26 VanDerWaalsContact O-N 3.16Å; Y24-A26 VanDerWaalsContact C-N 3.34Å; A26-D28 PolarHBondContact O-N 3.35Å
27L89.4Confident89.7Confident38 Ų3858.4 Ų58.420%0.19933%0.325CS..SBendtrans-70.3124.4174.8-61.3-177.7000110.7H23 Y24 K25 M29 F124 I125 L129H23-L27 WeakPolarHBondContact O-CG 3.37Å; H23-L27 PolarHBondContact O-N 3.49Å; Y24-L27 HydrophobicContact CD2-CD1 4.42Å; Y24-L27 WeakPolarHBondContact O-CB 3.24Å; Y24-L27 PolarHBondContact O-N 2.87Å; K25-L27 VanDerWaalsContact C-N 3.27Å; L27-M29 HydrophobicContact CB-CE 4.36Å; L27-M29 HydrophobicContact CB-CG 4.07Å; L27-M29 HydrophobicContact CD1-CE 4.15Å; L27-M29 HydrophobicContact CD1-SD 4.29Å; L27-M29 PolarHBondContact O-N 3Å; L27-M29 VanDerWaalsContact O-N 3.1Å; L27-F124 WeakPolarHBondContact CD1-O 3.24Å; L27-F124 VanDerWaalsContact CD2-O 3.25Å; L27-F124 WeakPolarHBondContact CD2-O 3.43Å; L27-I125 HydrophobicContact CD1-CB 4.46Å; L27-I125 HydrophobicContact CD1-CG1 3.72Å; L27-L129 HydrophobicContact CD1-CD2 3.71Å; L27-L129 HydrophobicContact CG-CD2 4.41Å
28D83.9Confident89.5Confident121 Ų12158.6 Ų58.665%0.64733%0.327SS*.  trans-83.483.8171.4-17020.8000110.2A26 Q33A26-D28 PolarHBondContact O-N 3.35Å; D28-Q33 PolarHBondContact OD1-NE2 2.98Å
29M83.9Confident89.4Confident6 Ų659.8 Ų59.83%0.0333%0.328CS..  trans-104.2132.2177.8-68.6-166.5-64.800110.9Y24 L27 A31 H32 L121 F124 I125Y24-M29 HydrophobicContact CD2-CE 4.33Å; Y24-M29 HydrophobicContact CE2-CE 3.66Å; L27-M29 HydrophobicContact CB-CE 4.36Å; L27-M29 HydrophobicContact CB-CG 4.07Å; L27-M29 HydrophobicContact CD1-CE 4.15Å; L27-M29 HydrophobicContact CD1-SD 4.29Å; L27-M29 PolarHBondContact O-N 3Å; L27-M29 VanDerWaalsContact O-N 3.1Å; M29-A31 PolarHBondContact O-N 3.34Å; M29-H32 WeakPolarHBondContact CE-CE1 3.34Å; M29-H32 WeakPolarHBondContact CE-NE2 3.26Å; M29-H32 WeakPolarHBondContact O-CB 3.38Å; M29-H32 PolarHBondContact O-N 3.2Å; M29-L121 HydrophobicContact SD-CD2 4.47Å; M29-F124 HydrophobicContact CG-CB 3.59Å; M29-F124 HydrophobicContact CG-CD1 3.83Å; M29-F124 HydrophobicContact CG-CG 3.75Å; M29-F124 HydrophobicContact SD-CB 3.6Å; M29-F124 HydrophobicContact SD-CG 4.2Å; M29-I125 HydrophobicContact CE-CD1 4.13Å; M29-I125 HydrophobicContact CE-CG1 4.25Å; M29-I125 HydrophobicContact SD-CD1 3.85Å; M29-I125 HydrophobicContact SD-CG1 3.74Å
30P81.3Confident89.3Confident82 Ų8258.4 Ų58.453%0.53232%0.316SS..Hα-helixtrans-53.6-34175.5-26.833.9000112.8H32 Q33P30-H32 PolarHBondContact O-N 3.07Å; P30-Q33 PolarHBondContact O-N 3.32Å; P30-Q33 VanDerWaalsContact O-N 3.08Å
31A77.9Confident89.2Confident28 Ų2860 Ų6023%0.23132%0.322CS..Hα-helixtrans-61.1-26.3177.600000113.9M29 T34 K40 F41M29-A31 PolarHBondContact O-N 3.34Å; A31-T34 PolarHBondContact O-OG1 2.81Å; A31-K40 PolarHBondContact O-NZ 3.32Å; A31-F41 HydrophobicContact CB-CE2 4.35Å; A31-F41 HydrophobicContact CB-CZ 4.17Å
32H81.7Confident89.3Confident35 Ų3559.3 Ų59.316%0.16232%0.319CS..Hα-helixtrans-77.6-22.6176.4-70.1175.7000113.3Y24 M29 P30 G37Y24-H32 AromaticContact CE1-CE1 3.75Å; Y24-H32 AromaticContact CE1-NE2 3.44Å; Y24-H32 WeakPolarHBondContact CE1-NE2 3.28Å; Y24-H32 AromaticContact CE2-NE2 3.82Å; Y24-H32 AromaticContact CZ-CE1 3.74Å; Y24-H32 AromaticContact CZ-NE2 3.15Å; Y24-H32 PolarHBondContact O-CE1 3.26Å; Y24-H32 PolarHBondContact OH-NE2 3.43Å; M29-H32 WeakPolarHBondContact CE-CE1 3.34Å; M29-H32 WeakPolarHBondContact CE-NE2 3.26Å; M29-H32 WeakPolarHBondContact O-CB 3.38Å; M29-H32 PolarHBondContact O-N 3.2Å; P30-H32 PolarHBondContact O-N 3.07Å; H32-G37 VanDerWaalsContact O-CA 3.31Å; H32-G37 WeakPolarHBondContact O-CA 3.47Å
33Q80.8Confident89.3Confident146 Ų14656.2 Ų56.268%0.68230%0.297SS*.Hα-helixtrans-86.6-13.2-178.7-57-179.22.100112.3D28 P30D28-Q33 PolarHBondContact OD1-NE2 2.98Å; P30-Q33 PolarHBondContact O-N 3.32Å; P30-Q33 VanDerWaalsContact O-N 3.08Å
34T86.2Confident89.4Confident62 Ų6252.2 Ų52.238%0.3828%0.278SS..SBendtrans-76.6163.3174.562.50000112.8A31 G36 G37 K40A31-T34 PolarHBondContact O-OG1 2.81Å; T34-G36 PolarHBondContact O-N 2.93Å; T34-G37 WeakPolarHBondContact O-CA 3.35Å; T34-G37 PolarHBondContact O-N 3.34Å; T34-K40 PolarHBondContact OG1-NZ 3.25Å
35Y88.8Confident89.7Confident107 Ų10752.8 Ų52.842%0.4228%0.282SS..THydrogen-bonded Turntrans-51.8136176.1-175.1-97.1000112.2G37 W172 W175 V176 V179 T180Y35-G37 PolarHBondContact O-N 3.48Å; Y35-W172 HydrophobicContact CE1-CH2 4.11Å; Y35-W172 HydrophobicContact CE1-CZ3 4.39Å; Y35-W175 AromaticContact CE1-CD1 3.95Å; Y35-W175 AromaticContact CE1-NE1 3.83Å; Y35-W175 AromaticContact CZ-NE1 3.84Å; Y35-W175 PolarHBondContact OH-NE1 2.87Å; Y35-V176 HydrophobicContact CD1-CG2 4.46Å; Y35-V179 HydrophobicContact CD1-CB 4.06Å; Y35-V179 HydrophobicContact CD1-CG1 3.8Å; Y35-V179 HydrophobicContact CD2-CG1 4.1Å; Y35-V179 HydrophobicContact CE1-CB 4.04Å; Y35-V179 HydrophobicContact CE1-CG1 3.97Å; Y35-V179 HydrophobicContact CE1-CG2 4.04Å; Y35-V179 HydrophobicContact CE2-CG1 4.25Å; Y35-V179 HydrophobicContact CG-CG1 3.86Å; Y35-T180 HydrophobicContact CD1-CG2 4.31Å; Y35-T180 HydrophobicContact CG-CG2 4.36Å
36G87.8Confident90Very high21 Ų2147.9 Ų47.922%0.21626%0.261CS..THydrogen-bonded Turntrans80.2-14.9-172.900000114.7T34 S38 W39 K40T34-G36 PolarHBondContact O-N 2.93Å; G36-S38 PolarHBondContact O-N 3.4Å; G36-W39 WeakPolarHBondContact O-CA 3.33Å; G36-W39 WeakPolarHBondContact O-CB 3.16Å; G36-W39 PolarHBondContact O-N 3.4Å; G36-K40 PolarHBondContact O-N 3.01Å
37G92.6Very high90.4Very high14 Ų1444 Ų4414%0.14423%0.229CC..G310 helixtrans48.2-135.1175.700000113.3H32 T34 Y35 W39 K40H32-G37 VanDerWaalsContact O-CA 3.31Å; H32-G37 WeakPolarHBondContact O-CA 3.47Å; T34-G37 WeakPolarHBondContact O-CA 3.35Å; T34-G37 PolarHBondContact O-N 3.34Å; Y35-G37 PolarHBondContact O-N 3.48Å; G37-W39 VanDerWaalsContact C-N 3.26Å; G37-W39 PolarHBondContact O-N 3.49Å; G37-K40 WeakPolarHBondContact O-CD 3.28Å; G37-K40 VanDerWaalsContact O-CG 3.29Å; G37-K40 WeakPolarHBondContact O-CG 3.44Å
38S93.3Very high90.8Very high4 Ų444 Ų443%0.02823%0.23CC..G310 helixtrans-65.4-27.6174.5-46.30000113.6K25 G36 K40 F41 F44K25-S38 PolarHBondContact NZ-OG 2.93Å; G36-S38 PolarHBondContact O-N 3.4Å; S38-K40 PolarHBondContact O-N 2.8Å; S38-F41 PolarHBondContact O-N 3.38Å; S38-F41 VanDerWaalsContact O-N 3.16Å; S38-F44 WeakPolarHBondContact O-CB 3.31Å
39W94.9Very high91.5Very high128 Ų12839.1 Ų39.149%0.48520%0.204SC..G310 helixtrans-73.3-8.7-173.7-66.6102.4000114G36 G37 F41 F44 I45 V48 W172G36-W39 WeakPolarHBondContact O-CA 3.33Å; G36-W39 WeakPolarHBondContact O-CB 3.16Å; G36-W39 PolarHBondContact O-N 3.4Å; G37-W39 VanDerWaalsContact C-N 3.26Å; G37-W39 PolarHBondContact O-N 3.49Å; W39-F41 VanDerWaalsContact C-N 3.26Å; W39-F44 AromaticContact CD2-CD1 3.99Å; W39-F44 HydrophobicContact CD2-CD1 3.99Å; W39-F44 AromaticContact CD2-CE1 3.71Å; W39-F44 HydrophobicContact CD2-CE1 3.71Å; W39-F44 AromaticContact CE2-CE1 3.63Å; W39-F44 HydrophobicContact CE3-CD1 4.05Å; W39-F44 HydrophobicContact CE3-CE1 4Å; W39-F44 HydrophobicContact CG-CD1 4.34Å; W39-F44 HydrophobicContact CG-CE1 4.23Å; W39-F44 HydrophobicContact CH2-CE1 4.17Å; W39-F44 AromaticContact CZ2-CE1 3.89Å; W39-F44 HydrophobicContact CZ2-CE1 3.89Å; W39-F44 HydrophobicContact CZ3-CD1 4.5Å; W39-F44 HydrophobicContact CZ3-CE1 4.22Å; W39-I45 HydrophobicContact CE3-CG1 4.05Å; W39-V48 HydrophobicContact CH2-CB 4.36Å; W39-V48 HydrophobicContact CH2-CG1 4.06Å; W39-V48 HydrophobicContact CH2-CG2 3.99Å; W39-V48 HydrophobicContact CZ3-CB 4.48Å; W39-V48 HydrophobicContact CZ3-CG1 4.49Å; W39-V48 HydrophobicContact CZ3-CG2 4.3Å; W39-W172 PolarHBondContact O-NE1 3.16Å
40K94.9Very high92.2Very high25 Ų2538.9 Ų38.911%0.10920%0.202CC..G310 helixtrans-69.6-26.8169.475.5-167.6-179.3175.70112.2A31 T34 G36 G37 S38 Y169 V176 V184A31-K40 PolarHBondContact O-NZ 3.32Å; T34-K40 PolarHBondContact OG1-NZ 3.25Å; G36-K40 PolarHBondContact O-N 3.01Å; G37-K40 WeakPolarHBondContact O-CD 3.28Å; G37-K40 VanDerWaalsContact O-CG 3.29Å; G37-K40 WeakPolarHBondContact O-CG 3.44Å; S38-K40 PolarHBondContact O-N 2.8Å; K40-Y169 PolarHBondContact O-OH 2.94Å; K40-V176 HydrophobicContact CB-CG2 4.33Å; K40-V184 HydrophobicContact CB-CG1 4.38Å; K40-V184 HydrophobicContact CB-CG2 3.9Å; K40-V184 HydrophobicContact CD-CG2 4.46Å; K40-V184 HydrophobicContact CG-CG1 4.12Å; K40-V184 HydrophobicContact CG-CG2 4.23Å; K40-V184 WeakPolarHBondContact O-CG1 3.24Å
41F95.8Very high93Very high43 Ų4335.3 Ų35.319%0.18918%0.18CC..SBendtrans-88.7128.2-177.1-57.6-70.1000111.9A31 S38 W39 T43 F44 I45 V184A31-F41 HydrophobicContact CB-CE2 4.35Å; A31-F41 HydrophobicContact CB-CZ 4.17Å; S38-F41 PolarHBondContact O-N 3.38Å; S38-F41 VanDerWaalsContact O-N 3.16Å; W39-F41 VanDerWaalsContact C-N 3.26Å; F41-T43 VanDerWaalsContact C-N 3.27Å; F41-T43 PolarHBondContact O-N 3.43Å; F41-F44 HydrophobicContact CB-CB 4.43Å; F41-F44 PolarHBondContact O-N 2.8Å; F41-F44 VanDerWaalsContact O-N 3.12Å; F41-I45 PolarHBondContact O-N 3.03Å; F41-V184 HydrophobicContact CD1-CG1 3.82Å; F41-V184 HydrophobicContact CE1-CG1 4.07Å
42L97.4Very high94Very high10 Ų1037.8 Ų37.85%0.05219%0.192CC..Hα-helixtrans-62.8-37.3179.1-172.458.6000111.4F44 I45 D46 V97 F100 V101 F165 Y169 Y185L42-F44 PolarHBondContact O-N 2.77Å; L42-I45 HydrophobicContact CD1-CB 4.46Å; L42-I45 HydrophobicContact CD1-CD1 4.5Å; L42-I45 WeakPolarHBondContact O-CB 3.39Å; L42-I45 PolarHBondContact O-N 2.89Å; L42-I45 VanDerWaalsContact O-N 3.11Å; L42-D46 WeakPolarHBondContact O-CB 3.27Å; L42-D46 PolarHBondContact O-N 3.46Å; L42-V97 HydrophobicContact CD1-CG1 4.27Å; L42-F100 HydrophobicContact CD2-CD1 3.77Å; L42-F100 HydrophobicContact CD2-CE1 3.62Å; L42-V101 HydrophobicContact CB-CG2 4.5Å; L42-V101 HydrophobicContact CD2-CG2 3.92Å; L42-V101 HydrophobicContact CG-CG2 3.8Å; L42-F165 HydrophobicContact CD1-CE1 4.12Å; L42-F165 HydrophobicContact CD1-CZ 4.18Å; L42-Y169 HydrophobicContact CB-CD1 4.39Å; L42-Y169 HydrophobicContact CB-CE1 3.71Å; L42-Y169 HydrophobicContact CB-CE2 4.15Å; L42-Y169 HydrophobicContact CD1-CD1 4.05Å; L42-Y169 HydrophobicContact CD1-CD2 4.07Å; L42-Y169 HydrophobicContact CD1-CE1 4.21Å; L42-Y169 HydrophobicContact CD1-CE2 4.25Å; L42-Y169 HydrophobicContact CD1-CG 3.99Å; L42-Y169 HydrophobicContact CD2-CD1 4.24Å; L42-Y169 HydrophobicContact CD2-CE1 4.15Å; L42-Y169 HydrophobicContact CG-CD1 4.46Å; L42-Y169 HydrophobicContact CG-CE1 4.24Å; L42-Y169 PolarHBondContact N-OH 2.88Å; L42-Y169 VanDerWaalsContact N-OH 3.09Å; L42-Y185 VanDerWaalsContact CB-OH 3.29Å; L42-Y185 WeakPolarHBondContact CB-OH 3.48Å; L42-Y185 PolarHBondContact N-OH 2.86Å
43T96.4Very high94.8Very high20 Ų2036.1 Ų36.112%0.12318%0.184CC..Hα-helixtrans-54.2-41.9174.8-49.50000111.8F41 D46 L47 V101 M133 H134F41-T43 VanDerWaalsContact C-N 3.27Å; F41-T43 PolarHBondContact O-N 3.43Å; T43-D46 PolarHBondContact O-N 3.1Å; T43-L47 HydrophobicContact CG2-CD1 4.32Å; T43-L47 VanDerWaalsContact O-CG 3.26Å; T43-L47 WeakPolarHBondContact O-CG 3.26Å; T43-L47 PolarHBondContact O-N 3.35Å; T43-V101 HydrophobicContact CG2-CG1 4.33Å; T43-M133 HydrophobicContact CG2-CB 3.79Å; T43-H134 WeakPolarHBondContact CG2-NE2 3.34Å; T43-H134 PolarHBondContact OG1-NE2 2.87Å
44F96.9Very high95.6Very high8 Ų829.2 Ų29.24%0.03515%0.152CC..Hα-helixtrans-69.3-41.2178.7-177.7-101.1000111.8L21 Y24 K25 S38 W39 F41 L42 D46 L47 V48L21-F44 HydrophobicContact CD2-CD2 4.18Å; L21-F44 HydrophobicContact CD2-CE2 3.65Å; L21-F44 HydrophobicContact CD2-CZ 4.34Å; Y24-F44 AromaticContact CD1-CD2 3.56Å; Y24-F44 HydrophobicContact CD1-CD2 3.56Å; Y24-F44 AromaticContact CD1-CE2 3.88Å; Y24-F44 HydrophobicContact CD1-CE2 3.88Å; Y24-F44 HydrophobicContact CE1-CB 4.34Å; Y24-F44 AromaticContact CE1-CD2 3.38Å; Y24-F44 HydrophobicContact CE1-CD2 3.38Å; Y24-F44 HydrophobicContact CE1-CE2 4.02Å; Y24-F44 HydrophobicContact CE1-CG 4.1Å; K25-F44 HydrophobicContact CD-CE2 4.44Å; K25-F44 HydrophobicContact CG-CE2 4.48Å; S38-F44 WeakPolarHBondContact O-CB 3.31Å; W39-F44 AromaticContact CD2-CD1 3.99Å; W39-F44 HydrophobicContact CD2-CD1 3.99Å; W39-F44 AromaticContact CD2-CE1 3.71Å; W39-F44 HydrophobicContact CD2-CE1 3.71Å; W39-F44 AromaticContact CE2-CE1 3.63Å; W39-F44 HydrophobicContact CE3-CD1 4.05Å; W39-F44 HydrophobicContact CE3-CE1 4Å; W39-F44 HydrophobicContact CG-CD1 4.34Å; W39-F44 HydrophobicContact CG-CE1 4.23Å; W39-F44 HydrophobicContact CH2-CE1 4.17Å; W39-F44 AromaticContact CZ2-CE1 3.89Å; W39-F44 HydrophobicContact CZ2-CE1 3.89Å; W39-F44 HydrophobicContact CZ3-CD1 4.5Å; W39-F44 HydrophobicContact CZ3-CE1 4.22Å; F41-F44 HydrophobicContact CB-CB 4.43Å; F41-F44 PolarHBondContact O-N 2.8Å; F41-F44 VanDerWaalsContact O-N 3.12Å; L42-F44 PolarHBondContact O-N 2.77Å; F44-D46 VanDerWaalsContact C-N 3.33Å; F44-D46 PolarHBondContact O-N 3.33Å; F44-L47 PolarHBondContact O-N 3.01Å; F44-V48 HydrophobicContact CD1-CG2 4.46Å; F44-V48 HydrophobicContact CE1-CG2 3.95Å; F44-V48 HydrophobicContact CE2-CG2 4.49Å; F44-V48 HydrophobicContact CZ-CG2 3.94Å; F44-V48 WeakPolarHBondContact O-CG2 3.36Å; F44-V48 PolarHBondContact O-N 2.77Å; F44-V48 VanDerWaalsContact O-N 3.12Å
45I98.1Very high96.2Very high26 Ų2627.4 Ų27.413%0.13315%0.146CC..Hα-helixtrans-60.3-45.4175.1-61.2171.3000110.2W39 F41 L42 V48 I49 F165 Y169W39-I45 HydrophobicContact CE3-CG1 4.05Å; F41-I45 PolarHBondContact O-N 3.03Å; L42-I45 HydrophobicContact CD1-CB 4.46Å; L42-I45 HydrophobicContact CD1-CD1 4.5Å; L42-I45 WeakPolarHBondContact O-CB 3.39Å; L42-I45 PolarHBondContact O-N 2.89Å; L42-I45 VanDerWaalsContact O-N 3.11Å; I45-V48 PolarHBondContact O-N 3.45Å; I45-I49 HydrophobicContact CG2-CD1 3.86Å; I45-I49 HydrophobicContact CG2-CG1 4.41Å; I45-I49 WeakPolarHBondContact O-CG1 3.42Å; I45-I49 PolarHBondContact O-N 3.43Å; I45-F165 HydrophobicContact CG2-CE2 4.49Å; I45-F165 HydrophobicContact CG2-CZ 4.17Å; I45-Y169 HydrophobicContact CD1-CD2 3.71Å; I45-Y169 HydrophobicContact CD1-CE2 3.67Å
46D98.4Very high96.6Very high0 Ų023.1 Ų23.10%013%0.13CC..Hα-helixtrans-59.6-49177.5179.344.2000111.2L42 T43 F44 V48 I49 Q50 V97 G98 V101L42-D46 WeakPolarHBondContact O-CB 3.27Å; L42-D46 PolarHBondContact O-N 3.46Å; T43-D46 PolarHBondContact O-N 3.1Å; F44-D46 VanDerWaalsContact C-N 3.33Å; F44-D46 PolarHBondContact O-N 3.33Å; D46-V48 PolarHBondContact O-N 2.8Å; D46-I49 CarbonylContact O-C 3.58Å; D46-I49 WeakPolarHBondContact O-CA 3.17Å; D46-I49 WeakPolarHBondContact O-CB 3.28Å; D46-I49 PolarHBondContact O-N 2.81Å; D46-Q50 VanDerWaalsContact O-CG 3.31Å; D46-Q50 WeakPolarHBondContact O-CG 3.37Å; D46-Q50 PolarHBondContact O-N 2.78Å; D46-Q50 PolarHBondContact OD1-NE2 3.13Å; D46-V97 HydrophobicContact CB-CG1 3.99Å; D46-G98 WeakPolarHBondContact OD1-CA 3.27Å; D46-G98 PolarHBondContact OD1-N 3.28Å; D46-V101 HydrophobicContact CB-CG2 3.98Å
47L98.2Very high97Very high1 Ų122.1 Ų22.11%0.00512%0.12CC..Hα-helixtrans-57.2-37.9176.7-69.6166.4000113.3Y17 I20 L21 T43 F44 A51 M133 V137Y17-L47 HydrophobicContact CD1-CD2 3.91Å; Y17-L47 HydrophobicContact CE1-CD2 3.88Å; I20-L47 HydrophobicContact CG2-CD1 4.07Å; I20-L47 HydrophobicContact CG2-CD2 4.08Å; L21-L47 HydrophobicContact CD2-CB 3.85Å; L21-L47 HydrophobicContact CG-CB 4.43Å; T43-L47 HydrophobicContact CG2-CD1 4.32Å; T43-L47 VanDerWaalsContact O-CG 3.26Å; T43-L47 WeakPolarHBondContact O-CG 3.26Å; T43-L47 PolarHBondContact O-N 3.35Å; F44-L47 PolarHBondContact O-N 3.01Å; L47-A51 WeakPolarHBondContact O-CB 3.06Å; L47-A51 PolarHBondContact O-N 3.12Å; L47-M133 HydrophobicContact CD1-CB 4.04Å; L47-M133 HydrophobicContact CD1-CG 3.66Å; L47-M133 HydrophobicContact CD1-SD 4.32Å; L47-V137 HydrophobicContact CD2-CG2 4.31Å
48V98.3Very high97.2Very high36 Ų3622.6 Ų22.622%0.21812%0.12CC..Hα-helixtrans-67.8-44.2173.7175.10000110.8L21 W39 F44 I45 D46 Q50 A51 V52L21-V48 HydrophobicContact CD2-CG2 4.16Å; W39-V48 HydrophobicContact CH2-CB 4.36Å; W39-V48 HydrophobicContact CH2-CG1 4.06Å; W39-V48 HydrophobicContact CH2-CG2 3.99Å; W39-V48 HydrophobicContact CZ3-CB 4.48Å; W39-V48 HydrophobicContact CZ3-CG1 4.49Å; W39-V48 HydrophobicContact CZ3-CG2 4.3Å; F44-V48 HydrophobicContact CD1-CG2 4.46Å; F44-V48 HydrophobicContact CE1-CG2 3.95Å; F44-V48 HydrophobicContact CE2-CG2 4.49Å; F44-V48 HydrophobicContact CZ-CG2 3.94Å; F44-V48 WeakPolarHBondContact O-CG2 3.36Å; F44-V48 PolarHBondContact O-N 2.77Å; F44-V48 VanDerWaalsContact O-N 3.12Å; I45-V48 PolarHBondContact O-N 3.45Å; D46-V48 PolarHBondContact O-N 2.8Å; V48-Q50 VanDerWaalsContact C-N 3.32Å; V48-Q50 PolarHBondContact O-N 3.37Å; V48-A51 PolarHBondContact O-N 3.04Å; V48-V52 HydrophobicContact CG1-CG2 4.21Å; V48-V52 WeakPolarHBondContact O-CB 3.31Å; V48-V52 VanDerWaalsContact O-CG2 3.27Å; V48-V52 WeakPolarHBondContact O-CG2 3.39Å; V48-V52 PolarHBondContact O-N 3.3Å
49I98.4Very high97.3Very high20 Ų2026.5 Ų26.510%0.10314%0.14CC..Hα-helixtrans-56.4-47.9174.8-71.2167.3000110.3I45 D46 V52 F53 L93 A94 F165I45-I49 HydrophobicContact CG2-CD1 3.86Å; I45-I49 HydrophobicContact CG2-CG1 4.41Å; I45-I49 WeakPolarHBondContact O-CG1 3.42Å; I45-I49 PolarHBondContact O-N 3.43Å; D46-I49 CarbonylContact O-C 3.58Å; D46-I49 WeakPolarHBondContact O-CA 3.17Å; D46-I49 WeakPolarHBondContact O-CB 3.28Å; D46-I49 PolarHBondContact O-N 2.81Å; I49-V52 PolarHBondContact O-N 3.37Å; I49-F53 VanDerWaalsContact O-CB 3.22Å; I49-F53 WeakPolarHBondContact O-CB 3.42Å; I49-F53 PolarHBondContact O-N 3.1Å; I49-L93 HydrophobicContact CG2-CB 3.85Å; I49-A94 HydrophobicContact CG2-CB 4.21Å; I49-F165 HydrophobicContact CD1-CE2 4.07Å; I49-F165 HydrophobicContact CD1-CZ 3.96Å
50Q98.4Very high97.3Very high0 Ų020.8 Ų20.80%012%0.119CC..Hα-helixtrans-61.6-46.8178.2-60.5-56.5-32.700111.5Y17 D46 V48 V52 F53 F54 A94 V137Y17-Q50 HydrophobicContact CD1-CB 4.12Å; Y17-Q50 HydrophobicContact CD2-CB 4.16Å; Y17-Q50 HydrophobicContact CE1-CB 3.63Å; Y17-Q50 HydrophobicContact CE1-CG 4.01Å; Y17-Q50 HydrophobicContact CE2-CB 3.65Å; Y17-Q50 HydrophobicContact CE2-CG 4.48Å; Y17-Q50 HydrophobicContact CG-CB 4.37Å; Y17-Q50 WeakPolarHBondContact OH-CG 3.47Å; D46-Q50 VanDerWaalsContact O-CG 3.31Å; D46-Q50 WeakPolarHBondContact O-CG 3.37Å; D46-Q50 PolarHBondContact O-N 2.78Å; D46-Q50 PolarHBondContact OD1-NE2 3.13Å; V48-Q50 VanDerWaalsContact C-N 3.32Å; V48-Q50 PolarHBondContact O-N 3.37Å; Q50-V52 PolarHBondContact O-N 3.02Å; Q50-F53 PolarHBondContact O-N 3.01Å; Q50-F54 WeakPolarHBondContact O-CD2 3.24Å; Q50-F54 PolarHBondContact O-N 2.93Å; Q50-A94 PolarHBondContact NE2-O 3Å; Q50-V137 HydrophobicContact CG-CG1 3.85Å
51A98.3Very high97.2Very high8 Ų820.4 Ų20.47%0.06612%0.118CC..Hα-helixtrans-61.6-43.4178.900000112L14 L21 L47 V48 G55L14-A51 VanDerWaalsContact CD1-O 3.24Å; L14-A51 WeakPolarHBondContact CD1-O 3.37Å; L21-A51 HydrophobicContact CD1-CB 3.79Å; L47-A51 WeakPolarHBondContact O-CB 3.06Å; L47-A51 PolarHBondContact O-N 3.12Å; V48-A51 PolarHBondContact O-N 3.04Å; A51-G55 PolarHBondContact O-N 3.2Å
52V98.4Very high97Very high80 Ų8021.7 Ų21.749%0.48513%0.129SC..Hα-helixtrans-66.4-41.9176.71770000110.7V48 I49 Q50 G55 L56 M89V48-V52 HydrophobicContact CG1-CG2 4.21Å; V48-V52 WeakPolarHBondContact O-CB 3.31Å; V48-V52 VanDerWaalsContact O-CG2 3.27Å; V48-V52 WeakPolarHBondContact O-CG2 3.39Å; V48-V52 PolarHBondContact O-N 3.3Å; I49-V52 PolarHBondContact O-N 3.37Å; Q50-V52 PolarHBondContact O-N 3.02Å; V52-G55 PolarHBondContact O-N 3.01Å; V52-L56 WeakPolarHBondContact O-CB 3.04Å; V52-L56 PolarHBondContact O-N 3.4Å; V52-M89 HydrophobicContact CB-CE 4.47Å; V52-M89 HydrophobicContact CG1-CE 3.92Å
53F98.4Very high96.6Very high0 Ų022.6 Ų22.60%014%0.136CC..Hα-helixtrans-60.9-51.6177.4170.1-104.6000112I49 Q50 G55 L56 C57 R86 M89 M90 A94 I141 E144I49-F53 VanDerWaalsContact O-CB 3.22Å; I49-F53 WeakPolarHBondContact O-CB 3.42Å; I49-F53 PolarHBondContact O-N 3.1Å; Q50-F53 PolarHBondContact O-N 3.01Å; F53-G55 VanDerWaalsContact C-N 3.29Å; F53-G55 PolarHBondContact O-N 2.96Å; F53-L56 WeakPolarHBondContact O-CB 3.41Å; F53-L56 PolarHBondContact O-N 2.92Å; F53-L56 VanDerWaalsContact O-N 3.12Å; F53-C57 PolarHBondContact O-N 3.4Å; F53-C57 PolarHBondContact O-SG 3.34Å; F53-C57 VanDerWaalsContact O-SG 3.4Å; F53-R86 HydrophobicContact CD2-CG 4.47Å; F53-R86 HydrophobicContact CE2-CG 3.76Å; F53-R86 HydrophobicContact CZ-CG 4.48Å; F53-M89 HydrophobicContact CB-CE 4.38Å; F53-M89 HydrophobicContact CD2-CB 4.26Å; F53-M90 HydrophobicContact CE1-SD 3.98Å; F53-M90 HydrophobicContact CE2-CB 3.66Å; F53-M90 HydrophobicContact CE2-CG 4.35Å; F53-M90 HydrophobicContact CE2-SD 4.11Å; F53-M90 HydrophobicContact CZ-CB 3.99Å; F53-M90 HydrophobicContact CZ-CG 4.19Å; F53-M90 HydrophobicContact CZ-SD 3.52Å; F53-M90 VanDerWaalsContact CZ-SD 3.52Å; F53-A94 HydrophobicContact CB-CB 4.14Å; F53-A94 HydrophobicContact CD1-CB 4.09Å; F53-A94 HydrophobicContact CD2-CB 4.26Å; F53-A94 HydrophobicContact CG-CB 3.88Å; F53-I141 HydrophobicContact CD1-CD1 3.8Å; F53-I141 HydrophobicContact CE1-CD1 3.44Å; F53-I141 VanDerWaalsContact CE1-CD1 3.44Å; F53-I141 HydrophobicContact CZ-CD1 4.22Å; F53-E144 HydrophobicContact CE1-CB 4.45Å; F53-E144 HydrophobicContact CE1-CG 3.8Å; F53-E144 HydrophobicContact CZ-CG 3.8Å
54F98.1Very high96.2Very high0 Ų023.4 Ų23.40%014%0.143CC..Hα-helixtrans-66.8-31.6176.8-80.8-77.4000112.3R10 I13 L14 Y17 Q50 L56 C57 V58 F140 I141 E144R10-F54 HydrophobicContact CB-CD1 4.47Å; R10-F54 HydrophobicContact CG-CD1 4.31Å; I13-F54 HydrophobicContact CB-CD1 4.14Å; I13-F54 HydrophobicContact CB-CE1 4.15Å; I13-F54 HydrophobicContact CB-CG 4.49Å; I13-F54 HydrophobicContact CD1-CE1 3.84Å; I13-F54 HydrophobicContact CD1-CZ 4.14Å; I13-F54 HydrophobicContact CG2-CD1 3.75Å; I13-F54 HydrophobicContact CG2-CD2 3.67Å; I13-F54 HydrophobicContact CG2-CE1 3.71Å; I13-F54 HydrophobicContact CG2-CE2 3.64Å; I13-F54 HydrophobicContact CG2-CG 3.74Å; I13-F54 HydrophobicContact CG2-CZ 3.66Å; L14-F54 HydrophobicContact CB-CB 4.18Å; L14-F54 HydrophobicContact CD1-CB 4.22Å; Y17-F54 HydrophobicContact CD2-CD2 4.01Å; Y17-F54 AromaticContact CE2-CD2 3.52Å; Y17-F54 HydrophobicContact CE2-CD2 3.52Å; Y17-F54 AromaticContact CE2-CE2 3.72Å; Y17-F54 HydrophobicContact CE2-CE2 3.72Å; Y17-F54 HydrophobicContact CE2-CG 4.49Å; Q50-F54 WeakPolarHBondContact O-CD2 3.24Å; Q50-F54 PolarHBondContact O-N 2.93Å; F54-L56 VanDerWaalsContact C-N 3.33Å; F54-C57 PolarHBondContact O-N 3.47Å; F54-V58 WeakPolarHBondContact O-CG2 3.43Å; F54-V58 PolarHBondContact O-N 3.34Å; F54-F140 HydrophobicContact CE2-CB 4.45Å; F54-F140 HydrophobicContact CZ-CB 4.32Å; F54-I141 HydrophobicContact CE2-CD1 4.28Å; F54-I141 HydrophobicContact CZ-CD1 4.43Å; F54-E144 HydrophobicContact CE1-CB 3.98Å; F54-E144 HydrophobicContact CE1-CG 4.38Å; F54-E144 HydrophobicContact CZ-CB 3.95Å
55G97.9Very high95.7Very high24 Ų2427.3 Ų27.325%0.24716%0.163CC..Hα-helixtrans-59.6-42.9169.600000112.4A51 V52 F53 V58 L59A51-G55 PolarHBondContact O-N 3.2Å; V52-G55 PolarHBondContact O-N 3.01Å; F53-G55 VanDerWaalsContact C-N 3.29Å; F53-G55 PolarHBondContact O-N 2.96Å; G55-V58 PolarHBondContact O-N 2.87Å; G55-L59 WeakPolarHBondContact O-CB 3.25Å; G55-L59 PolarHBondContact O-N 2.74Å
56L97.4Very high95Very high17 Ų1732.2 Ų32.29%0.08919%0.189CC..Hα-helixtrans-65.3-41174.2178.860.7000111.8V52 F53 F54 L59 I60 L82 L85 R86 M89V52-L56 WeakPolarHBondContact O-CB 3.04Å; V52-L56 PolarHBondContact O-N 3.4Å; F53-L56 WeakPolarHBondContact O-CB 3.41Å; F53-L56 PolarHBondContact O-N 2.92Å; F53-L56 VanDerWaalsContact O-N 3.12Å; F54-L56 VanDerWaalsContact C-N 3.33Å; L56-L59 PolarHBondContact O-N 3.25Å; L56-I60 HydrophobicContact CD1-CD1 4.11Å; L56-I60 HydrophobicContact CD1-CG1 4.36Å; L56-I60 HydrophobicContact CG-CD1 4.02Å; L56-I60 WeakPolarHBondContact O-CD1 3.37Å; L56-I60 VanDerWaalsContact O-CG1 3.29Å; L56-I60 WeakPolarHBondContact O-CG1 3.41Å; L56-I60 PolarHBondContact O-N 2.87Å; L56-L82 HydrophobicContact CD1-CB 4.32Å; L56-L82 HydrophobicContact CD1-CD2 3.79Å; L56-L85 HydrophobicContact CD2-CB 4.28Å; L56-L85 HydrophobicContact CD2-CD2 3.97Å; L56-L85 HydrophobicContact CD2-CG 3.82Å; L56-R86 HydrophobicContact CD2-CB 3.78Å; L56-R86 HydrophobicContact CG-CB 4.11Å; L56-M89 HydrophobicContact CD2-SD 3.77Å
57C96.6Very high94Very high0 Ų033.4 Ų33.40%020%0.197CC..Hα-helixtrans-60.1-46.8174.3-66.40000111.9R10 F53 F54 L59 I60 D61R10-C57 HydrophobicContact CG-CB 4.27Å; F53-C57 PolarHBondContact O-N 3.4Å; F53-C57 PolarHBondContact O-SG 3.34Å; F53-C57 VanDerWaalsContact O-SG 3.4Å; F54-C57 PolarHBondContact O-N 3.47Å; C57-L59 PolarHBondContact O-N 3.26Å; C57-I60 PolarHBondContact O-N 3.28Å; C57-D61 PolarHBondContact O-N 3.12Å
58V96.8Very high92.6Very high25 Ų2541.6 Ų41.615%0.15223%0.232CC..Hα-helixtrans-63.6-40.8176.4172.20000111.4R10 V11 L14 F54 G55 I60 D61 V62R10-V58 HydrophobicContact CB-CG2 3.96Å; V11-V58 HydrophobicContact CG2-CG1 4.03Å; V11-V58 HydrophobicContact CG2-CG2 3.8Å; L14-V58 HydrophobicContact CD2-CB 4.25Å; L14-V58 HydrophobicContact CD2-CG2 3.94Å; F54-V58 WeakPolarHBondContact O-CG2 3.43Å; F54-V58 PolarHBondContact O-N 3.34Å; G55-V58 PolarHBondContact O-N 2.87Å; V58-I60 VanDerWaalsContact C-N 3.34Å; V58-I60 PolarHBondContact O-N 3.37Å; V58-D61 PolarHBondContact O-N 2.86Å; V58-V62 HydrophobicContact CG1-CG2 4.44Å; V58-V62 WeakPolarHBondContact O-CG2 3.43Å; V58-V62 PolarHBondContact O-N 3.28Å
59L95.3Very high90.9Very high86 Ų8644 Ų4445%0.4527%0.265SS..Hα-helixtrans-61.2-42.4176.3177.963000111.8G55 L56 C57 S63 L82G55-L59 WeakPolarHBondContact O-CB 3.25Å; G55-L59 PolarHBondContact O-N 2.74Å; L56-L59 PolarHBondContact O-N 3.25Å; C57-L59 PolarHBondContact O-N 3.26Å; L59-S63 VanDerWaalsContact O-CB 3.24Å; L59-S63 WeakPolarHBondContact O-CB 3.35Å; L59-S63 PolarHBondContact O-N 3.24Å; L59-S63 PolarHBondContact O-OG 3.49Å; L59-L82 HydrophobicContact CD2-CD1 4.42Å
60I94.5Very high89.3Confident7 Ų745.3 Ų45.34%0.03628%0.278CS..Hα-helixtrans-63.5-43.4175.6-72.5163.3000110.5L56 C57 V58 S63 S64 L79 L82 I83 R86L56-I60 HydrophobicContact CD1-CD1 4.11Å; L56-I60 HydrophobicContact CD1-CG1 4.36Å; L56-I60 HydrophobicContact CG-CD1 4.02Å; L56-I60 WeakPolarHBondContact O-CD1 3.37Å; L56-I60 VanDerWaalsContact O-CG1 3.29Å; L56-I60 WeakPolarHBondContact O-CG1 3.41Å; L56-I60 PolarHBondContact O-N 2.87Å; C57-I60 PolarHBondContact O-N 3.28Å; V58-I60 VanDerWaalsContact C-N 3.34Å; V58-I60 PolarHBondContact O-N 3.37Å; I60-S63 PolarHBondContact O-N 3.27Å; I60-S64 VanDerWaalsContact O-CB 3.32Å; I60-S64 WeakPolarHBondContact O-CB 3.48Å; I60-S64 PolarHBondContact O-N 3.4Å; I60-S64 PolarHBondContact O-OG 3.32Å; I60-L79 HydrophobicContact CG2-CD1 4.01Å; I60-L82 HydrophobicContact CD1-CB 4.08Å; I60-L82 HydrophobicContact CG1-CB 3.76Å; I60-I83 HydrophobicContact CD1-CG1 4.34Å; I60-I83 HydrophobicContact CG2-CG1 4.02Å; I60-R86 HydrophobicContact CD1-CB 3.66Å; I60-R86 HydrophobicContact CD1-CG 4.15Å
61D93.3Very high87.8Confident18 Ų1853.7 Ų53.710%0.09632%0.323CS..Hα-helixtrans-61.3-48.7178.1-74.7-20.3000111.3Q7 R10 C57 V58 S63 S64 L65Q7-D61 HydrophobicContact CG-CB 4.1Å; R10-D61 WeakPolarHBondContact CD-OD2 3.42Å; R10-D61 IonicContact CZ-OD1 2.9Å; R10-D61 IonicContact CZ-OD2 2.8Å; R10-D61 IonicContact NE-OD2 2.84Å; R10-D61 IonicContact NH1-OD1 3.43Å; R10-D61 PolarHBondContact NH1-OD1 3.02Å; R10-D61 IonicContact NH1-OD2 3.62Å; R10-D61 PolarHBondContact NH1-OD2 2.94Å; C57-D61 PolarHBondContact O-N 3.12Å; V58-D61 PolarHBondContact O-N 2.86Å; D61-S63 PolarHBondContact O-N 3.26Å; D61-S64 PolarHBondContact O-N 3.16Å; D61-S64 PolarHBondContact O-OG 2.71Å; D61-L65 WeakPolarHBondContact O-CG 3.32Å; D61-L65 PolarHBondContact O-N 3.25Å
62V91.6Very high86.9Confident70 Ų7055.8 Ų55.842%0.42434%0.337SS..Hα-helixtrans-61.3-46.1176.1173.80000110.9V58 S64 L65 L66V58-V62 HydrophobicContact CG1-CG2 4.44Å; V58-V62 WeakPolarHBondContact O-CG2 3.43Å; V58-V62 PolarHBondContact O-N 3.28Å; V62-S64 VanDerWaalsContact C-N 3.31Å; V62-S64 PolarHBondContact O-N 2.99Å; V62-L65 PolarHBondContact O-N 2.95Å; V62-L66 HydrophobicContact CG1-CD1 3.92Å; V62-L66 HydrophobicContact CG1-CG 4.38Å; V62-L66 WeakPolarHBondContact O-CG 3.48Å; V62-L66 PolarHBondContact O-N 3.31Å
63S89.3Confident86.2Confident29 Ų2962.5 Ų62.520%0.20335%0.354CS..Hα-helixtrans-61-41.7178.8-60.20000111.4L59 I60 D61 L65 L66 T67L59-S63 VanDerWaalsContact O-CB 3.24Å; L59-S63 WeakPolarHBondContact O-CB 3.35Å; L59-S63 PolarHBondContact O-N 3.24Å; L59-S63 PolarHBondContact O-OG 3.49Å; I60-S63 PolarHBondContact O-N 3.27Å; D61-S63 PolarHBondContact O-N 3.26Å; S63-L65 VanDerWaalsContact C-N 3.35Å; S63-L65 PolarHBondContact O-N 3.39Å; S63-L66 PolarHBondContact O-N 3.12Å; S63-T67 WeakPolarHBondContact O-CB 3.41Å; S63-T67 PolarHBondContact O-N 2.9Å; S63-T67 PolarHBondContact O-OG1 2.94Å
64S87.4Confident85.6Confident37 Ų3767.1 Ų67.126%0.25938%0.375SS..Hα-helixtrans-64.7-37.9177.977.50000112.5I60 D61 V62 T67 K68I60-S64 VanDerWaalsContact O-CB 3.32Å; I60-S64 WeakPolarHBondContact O-CB 3.48Å; I60-S64 PolarHBondContact O-N 3.4Å; I60-S64 PolarHBondContact O-OG 3.32Å; D61-S64 PolarHBondContact O-N 3.16Å; D61-S64 PolarHBondContact O-OG 2.71Å; V62-S64 VanDerWaalsContact C-N 3.31Å; V62-S64 PolarHBondContact O-N 2.99Å; S64-T67 PolarHBondContact O-N 3.4Å; S64-K68 PolarHBondContact O-N 3.47Å
65L86.7Confident84.9Confident89 Ų8970.5 Ų70.547%0.46639%0.391SS..Hα-helixtrans-67.9-42.8176.5-71.3172.3000111.5D61 V62 S63 T67 K68D61-L65 WeakPolarHBondContact O-CG 3.32Å; D61-L65 PolarHBondContact O-N 3.25Å; V62-L65 PolarHBondContact O-N 2.95Å; S63-L65 VanDerWaalsContact C-N 3.35Å; S63-L65 PolarHBondContact O-N 3.39Å; L65-T67 VanDerWaalsContact C-N 3.26Å; L65-T67 PolarHBondContact O-N 3.34Å; L65-K68 PolarHBondContact O-N 3Å
66L83.8Confident84.4Confident129 Ų12973.7 Ų73.768%0.67540%0.4SS*.Hα-helixtrans-69.3-24.2176.9-66.4175.3000113V62 S63V62-L66 HydrophobicContact CG1-CD1 3.92Å; V62-L66 HydrophobicContact CG1-CG 4.38Å; V62-L66 WeakPolarHBondContact O-CG 3.48Å; V62-L66 PolarHBondContact O-N 3.31Å; S63-L66 PolarHBondContact O-N 3.12Å
67T76.8Confident84Confident26 Ų2680 Ų8016%0.1642%0.422CS..Hα-helixtrans-83.4-18.9179.2-470000112.5S63 S64 L65 G69 A70 Q75S63-T67 WeakPolarHBondContact O-CB 3.41Å; S63-T67 PolarHBondContact O-N 2.9Å; S63-T67 PolarHBondContact O-OG1 2.94Å; S64-T67 PolarHBondContact O-N 3.4Å; L65-T67 VanDerWaalsContact C-N 3.26Å; L65-T67 PolarHBondContact O-N 3.34Å; T67-G69 VanDerWaalsContact C-N 3.33Å; T67-G69 PolarHBondContact O-N 3.09Å; T67-A70 PolarHBondContact O-N 3.38Å; T67-A70 VanDerWaalsContact O-N 3.16Å; T67-Q75 HydrophobicContact CG2-CG 4.38Å; T67-Q75 PolarHBondContact OG1-NE2 2.68Å
68K68.3Low83.7Confident172 Ų17283.8 Ų83.875%0.74844%0.44SS*.THydrogen-bonded Turntrans-6590.5176.4-80.8-178.6176.3-178.90110.1S64 L65S64-K68 PolarHBondContact O-N 3.47Å; L65-K68 PolarHBondContact O-N 3Å
69G63.9Low83.5Confident88 Ų8883.9 Ų83.991%0.90744%0.44SS*.THydrogen-bonded Turntrans120.9-4.8177.500000115.5T67T67-G69 VanDerWaalsContact C-N 3.33Å; T67-G69 PolarHBondContact O-N 3.09Å
70A63.4Low83.3Confident46 Ų4686 Ų8638%0.3845%0.445SS..  trans-104.4119.9176.300000110.8T67 S72T67-A70 PolarHBondContact O-N 3.38Å; T67-A70 VanDerWaalsContact O-N 3.16Å; A70-S72 PolarHBondContact O-N 3.42Å
71D67.2Low83.3Confident176 Ų17690.8 Ų90.894%0.94147%0.466SS*.  trans-81.742.9-176.8-1418.5000112.3
72S80.4Confident83.4Confident52 Ų5292 Ų9236%0.36447%0.472SS..  trans-94.999.1-176.4-178.30000111.2A70 E74 Q75 E76A70-S72 PolarHBondContact O-N 3.42Å; S72-E74 PolarHBondContact O-N 3.45Å; S72-Q75 PolarHBondContact O-N 3.4Å; S72-Q75 VanDerWaalsContact O-N 3.13Å; S72-E76 PolarHBondContact O-N 3.43Å
73R83.6Confident83.5Confident222 Ų22291.3 Ų91.384%0.83847%0.466SS*.Hα-helixtrans-55.4-34176.6-70.7-175.1177.4-177.4-0.6113.5R77R73-R77 PolarHBondContact O-N 2.92Å
74E85.4Confident83.9Confident96 Ų9691.9 Ų91.945%0.44948%0.475SS..Hα-helixtrans-70.7-40.1179.5-176.455.1-151.100111.2S72 E76 R77 Q78S72-E74 PolarHBondContact O-N 3.45Å; E74-E76 VanDerWaalsContact C-N 3.34Å; E74-E76 PolarHBondContact O-N 3.43Å; E74-R77 WeakPolarHBondContact O-CB 3.26Å; E74-R77 PolarHBondContact O-N 2.88Å; E74-Q78 WeakPolarHBondContact O-CG 3.48Å; E74-Q78 PolarHBondContact O-N 2.69Å; E74-Q78 PolarHBondContact OE1-NE2 3.4Å
75Q84.1Confident84.3Confident71 Ų7194 Ų9433%0.33248%0.484SS..Hα-helixtrans-64.2-40177.8-170.5168.9-40.100111.6T67 S72 R77 Q78 L79T67-Q75 HydrophobicContact CG2-CG 4.38Å; T67-Q75 PolarHBondContact OG1-NE2 2.68Å; S72-Q75 PolarHBondContact O-N 3.4Å; S72-Q75 VanDerWaalsContact O-N 3.13Å; Q75-R77 VanDerWaalsContact C-N 3.33Å; Q75-R77 PolarHBondContact O-N 3.16Å; Q75-Q78 PolarHBondContact O-N 2.9Å; Q75-L79 WeakPolarHBondContact O-CB 3.35Å; Q75-L79 PolarHBondContact O-N 2.95Å
76E87Confident84.8Confident91 Ų9190.8 Ų90.843%0.42547%0.465SS..Hα-helixtrans-61.8-40.8173.8-164.3-164.7154.500111.9S72 E74 L79 K80S72-E76 PolarHBondContact O-N 3.43Å; E74-E76 VanDerWaalsContact C-N 3.34Å; E74-E76 PolarHBondContact O-N 3.43Å; E76-L79 PolarHBondContact O-N 3.08Å; E76-K80 WeakPolarHBondContact O-CG 3.33Å; E76-K80 PolarHBondContact O-N 2.63Å; E76-K80 WeakPolarHBondContact OE1-CE 3.33Å; E76-K80 IonicContact OE1-NZ 3.25Å; E76-K80 PolarHBondContact OE1-NZ 3.44Å
77R89.1Confident85.5Confident149 Ų14985 Ų8556%0.56244%0.435SS*.Hα-helixtrans-63.3-42176.6-172-176.8-177.1-170.93111.9R73 E74 Q75 K80 K81R73-R77 PolarHBondContact O-N 2.92Å; E74-R77 WeakPolarHBondContact O-CB 3.26Å; E74-R77 PolarHBondContact O-N 2.88Å; Q75-R77 VanDerWaalsContact C-N 3.33Å; Q75-R77 PolarHBondContact O-N 3.16Å; R77-K80 PolarHBondContact O-N 3.43Å; R77-K81 PolarHBondContact O-N 3.44Å
78Q90.3Very high86.5Confident81 Ų8189.2 Ų89.238%0.37945%0.448SS..Hα-helixtrans-66.4-41.5176.8-64.2-60.6-30.700111.4E74 Q75 K80 K81 L82E74-Q78 WeakPolarHBondContact O-CG 3.48Å; E74-Q78 PolarHBondContact O-N 2.69Å; E74-Q78 PolarHBondContact OE1-NE2 3.4Å; Q75-Q78 PolarHBondContact O-N 2.9Å; Q78-K80 VanDerWaalsContact C-N 3.35Å; Q78-K80 PolarHBondContact O-N 2.89Å; Q78-K81 WeakPolarHBondContact O-CB 3.29Å; Q78-K81 PolarHBondContact O-N 2.85Å; Q78-K81 VanDerWaalsContact O-N 3.15Å; Q78-L82 WeakPolarHBondContact O-CG 3.39Å; Q78-L82 PolarHBondContact O-N 3.24Å
79L91.8Very high87.9Confident27 Ų2782 Ų8214%0.14142%0.417CS..Hα-helixtrans-58.7-44.4175.1-177.561.3000111.9I60 Q75 E76 K81 L82 I83I60-L79 HydrophobicContact CG2-CD1 4.01Å; Q75-L79 WeakPolarHBondContact O-CB 3.35Å; Q75-L79 PolarHBondContact O-N 2.95Å; E76-L79 PolarHBondContact O-N 3.08Å; L79-K81 VanDerWaalsContact C-N 3.31Å; L79-K81 PolarHBondContact O-N 3.42Å; L79-L82 PolarHBondContact O-N 2.91Å; L79-I83 HydrophobicContact CD1-CD1 4.31Å; L79-I83 HydrophobicContact CG-CD1 4Å; L79-I83 WeakPolarHBondContact O-CG1 3.5Å; L79-I83 PolarHBondContact O-N 3.39Å
80K91.9Very high89.5Confident129 Ų12977.8 Ų77.856%0.56137%0.374SS*.Hα-helixtrans-60.2-39.3175.7-73.5175.1-175.7167.90112.5E76 R77 Q78 I83 G84E76-K80 WeakPolarHBondContact O-CG 3.33Å; E76-K80 PolarHBondContact O-N 2.63Å; E76-K80 WeakPolarHBondContact OE1-CE 3.33Å; E76-K80 IonicContact OE1-NZ 3.25Å; E76-K80 PolarHBondContact OE1-NZ 3.44Å; R77-K80 PolarHBondContact O-N 3.43Å; Q78-K80 VanDerWaalsContact C-N 3.35Å; Q78-K80 PolarHBondContact O-N 2.89Å; K80-I83 PolarHBondContact O-N 3.41Å; K80-G84 PolarHBondContact O-N 3.45Å
81K94.2Very high91.1Very high108 Ų10875.6 Ų75.647%0.4736%0.356SS..Hα-helixtrans-65.4-43.1174.7-69.3175.5-176.5170.90111.9R77 Q78 L79 G84 L85R77-K81 PolarHBondContact O-N 3.44Å; Q78-K81 WeakPolarHBondContact O-CB 3.29Å; Q78-K81 PolarHBondContact O-N 2.85Å; Q78-K81 VanDerWaalsContact O-N 3.15Å; L79-K81 VanDerWaalsContact C-N 3.31Å; L79-K81 PolarHBondContact O-N 3.42Å; K81-G84 PolarHBondContact O-N 2.93Å; K81-L85 WeakPolarHBondContact O-CB 3.39Å; K81-L85 PolarHBondContact O-N 3.28Å
82L94.9Very high92.5Very high43 Ų4367.3 Ų67.323%0.22531%0.312CS..Hα-helixtrans-62.6-42.4176.9-69.2174000111.6L56 L59 I60 Q78 L79 L85 R86L56-L82 HydrophobicContact CD1-CB 4.32Å; L56-L82 HydrophobicContact CD1-CD2 3.79Å; L59-L82 HydrophobicContact CD2-CD1 4.42Å; I60-L82 HydrophobicContact CD1-CB 4.08Å; I60-L82 HydrophobicContact CG1-CB 3.76Å; Q78-L82 WeakPolarHBondContact O-CG 3.39Å; Q78-L82 PolarHBondContact O-N 3.24Å; L79-L82 PolarHBondContact O-N 2.91Å; L82-L85 PolarHBondContact O-N 2.82Å; L82-R86 WeakPolarHBondContact O-CB 3.47Å; L82-R86 PolarHBondContact O-N 3.42Å
83I95Very high93.3Very high57 Ų5766.3 Ų66.329%0.29230%0.302SS..Hα-helixtrans-60.9-45.6174.7-69.6167.3000110.7I60 L79 K80 L85 R86 D87I60-I83 HydrophobicContact CD1-CG1 4.34Å; I60-I83 HydrophobicContact CG2-CG1 4.02Å; L79-I83 HydrophobicContact CD1-CD1 4.31Å; L79-I83 HydrophobicContact CG-CD1 4Å; L79-I83 WeakPolarHBondContact O-CG1 3.5Å; L79-I83 PolarHBondContact O-N 3.39Å; K80-I83 PolarHBondContact O-N 3.41Å; I83-L85 VanDerWaalsContact C-N 3.34Å; I83-L85 PolarHBondContact O-N 2.99Å; I83-R86 WeakPolarHBondContact O-CB 3.44Å; I83-R86 PolarHBondContact O-N 3.2Å; I83-D87 PolarHBondContact O-N 2.87Å
84G96.1Very high94Very high40 Ų4055.7 Ų55.741%0.41226%0.262SS..Hα-helixtrans-61-41.4175.400000112.9K80 K81 D87 W88K80-G84 PolarHBondContact O-N 3.45Å; K81-G84 PolarHBondContact O-N 2.93Å; G84-D87 PolarHBondContact O-N 2.94Å; G84-W88 WeakPolarHBondContact O-CB 3.23Å; G84-W88 PolarHBondContact O-N 2.99Å
85L97Very high94.6Very high82 Ų8251.6 Ų51.643%0.42924%0.243SC..Hα-helixtrans-63.4-44.8174.7177.463.6000111.5L56 K81 L82 I83 D87 W88 M89L56-L85 HydrophobicContact CD2-CB 4.28Å; L56-L85 HydrophobicContact CD2-CD2 3.97Å; L56-L85 HydrophobicContact CD2-CG 3.82Å; K81-L85 WeakPolarHBondContact O-CB 3.39Å; K81-L85 PolarHBondContact O-N 3.28Å; L82-L85 PolarHBondContact O-N 2.82Å; I83-L85 VanDerWaalsContact C-N 3.34Å; I83-L85 PolarHBondContact O-N 2.99Å; L85-D87 PolarHBondContact O-N 3.4Å; L85-W88 PolarHBondContact O-N 2.79Å; L85-M89 HydrophobicContact CD1-CG 4.06Å; L85-M89 HydrophobicContact CD1-SD 4.16Å; L85-M89 HydrophobicContact CG-CG 4.34Å; L85-M89 HydrophobicContact CG-SD 4.05Å; L85-M89 WeakPolarHBondContact O-CB 2.94Å; L85-M89 VanDerWaalsContact O-CG 3.28Å; L85-M89 WeakPolarHBondContact O-CG 3.4Å; L85-M89 PolarHBondContact O-N 3.21Å
86R97.4Very high95.2Very high21 Ų2148.2 Ų48.28%0.07923%0.227CC..Hα-helixtrans-58.2-48.9177.4177.6-156.665.7-174.54.5110.9F53 L56 I60 L82 I83 M89 M90F53-R86 HydrophobicContact CD2-CG 4.47Å; F53-R86 HydrophobicContact CE2-CG 3.76Å; F53-R86 HydrophobicContact CZ-CG 4.48Å; L56-R86 HydrophobicContact CD2-CB 3.78Å; L56-R86 HydrophobicContact CG-CB 4.11Å; I60-R86 HydrophobicContact CD1-CB 3.66Å; I60-R86 HydrophobicContact CD1-CG 4.15Å; L82-R86 WeakPolarHBondContact O-CB 3.47Å; L82-R86 PolarHBondContact O-N 3.42Å; I83-R86 WeakPolarHBondContact O-CB 3.44Å; I83-R86 PolarHBondContact O-N 3.2Å; R86-M89 PolarHBondContact O-N 3.43Å; R86-M90 WeakPolarHBondContact O-CB 3.18Å; R86-M90 PolarHBondContact O-N 2.99Å
87D97.4Very high95.8Very high8 Ų843.9 Ų43.94%0.04321%0.207CC..Hα-helixtrans-65.7-41.1-178.4-745.1000111.6I83 G84 L85 M90 A91 H150 S151I83-D87 PolarHBondContact O-N 2.87Å; G84-D87 PolarHBondContact O-N 2.94Å; L85-D87 PolarHBondContact O-N 3.4Å; D87-M90 PolarHBondContact O-N 2.81Å; D87-A91 WeakPolarHBondContact O-CB 3.36Å; D87-A91 PolarHBondContact O-N 3.37Å; D87-H150 IonicContact OD1-CE1 2.83Å; D87-H150 IonicContact OD1-CG 2.83Å; D87-H150 IonicContact OD1-ND1 3.51Å; D87-H150 PolarHBondContact OD1-ND1 2.95Å; D87-S151 PolarHBondContact OD2-N 3.03Å; D87-S151 PolarHBondContact OD2-OG 3.37Å
88W97.5Very high96.2Very high114 Ų11436.8 Ų36.843%0.43218%0.18SC..Hα-helixtrans-63-46.3173.9-175.890000112G84 L85 M90 A91 V92 L93 A161G84-W88 WeakPolarHBondContact O-CB 3.23Å; G84-W88 PolarHBondContact O-N 2.99Å; L85-W88 PolarHBondContact O-N 2.79Å; W88-M90 VanDerWaalsContact C-N 3.35Å; W88-M90 PolarHBondContact O-N 3.5Å; W88-A91 PolarHBondContact O-N 3.11Å; W88-V92 HydrophobicContact CD2-CB 4.48Å; W88-V92 HydrophobicContact CD2-CG2 4.4Å; W88-V92 HydrophobicContact CH2-CG1 4.18Å; W88-V92 HydrophobicContact CZ2-CB 4.25Å; W88-V92 HydrophobicContact CZ2-CG1 3.94Å; W88-V92 HydrophobicContact CZ2-CG2 4.37Å; W88-V92 WeakPolarHBondContact O-CB 3.39Å; W88-V92 PolarHBondContact O-N 2.97Å; W88-L93 HydrophobicContact CH2-CD1 4.45Å; W88-L93 HydrophobicContact CZ3-CD1 3.92Å; W88-L93 HydrophobicContact CZ3-CG 4.36Å; W88-A161 HydrophobicContact CZ2-CB 4.41Å
89M97.8Very high96.6Very high20 Ų2033.2 Ų33.210%0.09916%0.164CC..Hα-helixtrans-62.1-41.9177.3-77.5-175.768.800111.8V52 F53 L56 L85 R86 L93 A94V52-M89 HydrophobicContact CB-CE 4.47Å; V52-M89 HydrophobicContact CG1-CE 3.92Å; F53-M89 HydrophobicContact CB-CE 4.38Å; F53-M89 HydrophobicContact CD2-CB 4.26Å; L56-M89 HydrophobicContact CD2-SD 3.77Å; L85-M89 HydrophobicContact CD1-CG 4.06Å; L85-M89 HydrophobicContact CD1-SD 4.16Å; L85-M89 HydrophobicContact CG-CG 4.34Å; L85-M89 HydrophobicContact CG-SD 4.05Å; L85-M89 WeakPolarHBondContact O-CB 2.94Å; L85-M89 VanDerWaalsContact O-CG 3.28Å; L85-M89 WeakPolarHBondContact O-CG 3.4Å; L85-M89 PolarHBondContact O-N 3.21Å; R86-M89 PolarHBondContact O-N 3.43Å; M89-L93 CarbonylContact O-C 3.54Å; M89-L93 WeakPolarHBondContact O-CA 3.36Å; M89-L93 WeakPolarHBondContact O-CB 3.16Å; M89-L93 PolarHBondContact O-N 3.45Å; M89-A94 PolarHBondContact O-N 2.66Å
90M97.5Very high96.9Very high0 Ų032.9 Ų32.90%016%0.162CC..Iπ-helixtrans-57.1-52.9175.2-179.859.3168.800110.9F53 R86 D87 W88 A94 F95 I141 M145 H150F53-M90 HydrophobicContact CE1-SD 3.98Å; F53-M90 HydrophobicContact CE2-CB 3.66Å; F53-M90 HydrophobicContact CE2-CG 4.35Å; F53-M90 HydrophobicContact CE2-SD 4.11Å; F53-M90 HydrophobicContact CZ-CB 3.99Å; F53-M90 HydrophobicContact CZ-CG 4.19Å; F53-M90 HydrophobicContact CZ-SD 3.52Å; F53-M90 VanDerWaalsContact CZ-SD 3.52Å; R86-M90 WeakPolarHBondContact O-CB 3.18Å; R86-M90 PolarHBondContact O-N 2.99Å; D87-M90 PolarHBondContact O-N 2.81Å; W88-M90 VanDerWaalsContact C-N 3.35Å; W88-M90 PolarHBondContact O-N 3.5Å; M90-A94 HydrophobicContact SD-CB 4.48Å; M90-F95 VanDerWaalsContact O-CB 3.31Å; M90-F95 WeakPolarHBondContact O-CB 3.36Å; M90-F95 PolarHBondContact O-N 2.64Å; M90-F95 HydrophobicContact SD-CB 4.4Å; M90-I141 HydrophobicContact CE-CD1 3.84Å; M90-I141 HydrophobicContact CE-CG1 3.74Å; M90-I141 HydrophobicContact SD-CD1 3.35Å; M90-I141 WeakPolarHBondContact SD-CD1 3.49Å; M90-I141 HydrophobicContact SD-CG1 3.71Å; M90-M145 HydrophobicContact CE-CB 3.73Å; M90-M145 HydrophobicContact CE-CE 3.71Å; M90-M145 HydrophobicContact CE-CG 4.25Å; M90-H150 HydrophobicContact CG-CB 4.15Å
91A96.8Very high97.2Very high0 Ų026.9 Ų26.90%014%0.136CC..Iπ-helixtrans-69.2-40-173.500000113.3D87 W88 P96 Y152 Y211D87-A91 WeakPolarHBondContact O-CB 3.36Å; D87-A91 PolarHBondContact O-N 3.37Å; W88-A91 PolarHBondContact O-N 3.11Å; A91-P96 VanDerWaalsContact O-CD 3.28Å; A91-P96 WeakPolarHBondContact O-CD 3.48Å; A91-P96 WeakPolarHBondContact O-CG 3.24Å; A91-Y152 HydrophobicContact CB-CD1 3.54Å; A91-Y152 HydrophobicContact CB-CD2 4.15Å; A91-Y152 HydrophobicContact CB-CE1 3.58Å; A91-Y152 HydrophobicContact CB-CE2 4.19Å; A91-Y152 HydrophobicContact CB-CG 3.83Å; A91-Y211 VanDerWaalsContact O-CD2 3.25Å; A91-Y211 WeakPolarHBondContact O-CD2 3.48Å
92V96.6Very high97.4Very high2 Ų222.5 Ų22.51%0.01212%0.118CC..Iπ-helixtrans-101.1-26.6-168.8177.60000113W88 P96 P153 A161 V162W88-V92 HydrophobicContact CD2-CB 4.48Å; W88-V92 HydrophobicContact CD2-CG2 4.4Å; W88-V92 HydrophobicContact CH2-CG1 4.18Å; W88-V92 HydrophobicContact CZ2-CB 4.25Å; W88-V92 HydrophobicContact CZ2-CG1 3.94Å; W88-V92 HydrophobicContact CZ2-CG2 4.37Å; W88-V92 WeakPolarHBondContact O-CB 3.39Å; W88-V92 PolarHBondContact O-N 2.97Å; V92-P96 VanDerWaalsContact C-CG 3.45Å; V92-P96 VanDerWaalsContact O-CG 3.25Å; V92-P96 WeakPolarHBondContact O-CG 3.26Å; V92-P153 HydrophobicContact CG2-CG 4.11Å; V92-A161 HydrophobicContact CG1-CB 3.41Å; V92-A161 VanDerWaalsContact CG1-CB 3.41Å; V92-A161 HydrophobicContact CG2-CB 4.4Å; V92-V162 HydrophobicContact CG1-CG2 4.12Å; V92-V162 WeakPolarHBondContact O-CG2 3.22Å
93L97.4Very high97.6Very high31 Ų3125.2 Ų25.216%0.16213%0.128CC..Iπ-helixtrans-119.1-69-175.5-61175.6000111.3I49 W88 M89 F95 V97 F165I49-L93 HydrophobicContact CG2-CB 3.85Å; W88-L93 HydrophobicContact CH2-CD1 4.45Å; W88-L93 HydrophobicContact CZ3-CD1 3.92Å; W88-L93 HydrophobicContact CZ3-CG 4.36Å; M89-L93 CarbonylContact O-C 3.54Å; M89-L93 WeakPolarHBondContact O-CA 3.36Å; M89-L93 WeakPolarHBondContact O-CB 3.16Å; M89-L93 PolarHBondContact O-N 3.45Å; L93-F95 PolarHBondContact O-N 3.25Å; L93-V97 WeakPolarHBondContact O-CB 3.48Å; L93-V97 WeakPolarHBondContact O-CG2 3.39Å; L93-V97 PolarHBondContact O-N 3.12Å; L93-F165 HydrophobicContact CD2-CD2 3.81Å; L93-F165 HydrophobicContact CD2-CE2 4.23Å; L93-F165 HydrophobicContact CD2-CG 4.17Å
94A97.9Very high97.7Very high0 Ų023.5 Ų23.50%012%0.121CC..Iπ-helixtrans-62.1-46.7-165.600000113I49 Q50 F53 M89 M90 G98 I141I49-A94 HydrophobicContact CG2-CB 4.21Å; Q50-A94 PolarHBondContact NE2-O 3Å; F53-A94 HydrophobicContact CB-CB 4.14Å; F53-A94 HydrophobicContact CD1-CB 4.09Å; F53-A94 HydrophobicContact CD2-CB 4.26Å; F53-A94 HydrophobicContact CG-CB 3.88Å; M89-A94 PolarHBondContact O-N 2.66Å; M90-A94 HydrophobicContact SD-CB 4.48Å; A94-G98 PolarHBondContact O-N 3.09Å; A94-I141 HydrophobicContact CB-CD1 3.88Å; A94-I141 HydrophobicContact CB-CG1 4.48Å
95F98.4Very high97.8Very high9 Ų922 Ų224%0.03910%0.102CC..Hα-helixtrans-71.7-59.3178-173.8-88000113.4M90 L93 V97 G98 A99 I141 M145 M210 G214 L217M90-F95 VanDerWaalsContact O-CB 3.31Å; M90-F95 WeakPolarHBondContact O-CB 3.36Å; M90-F95 PolarHBondContact O-N 2.64Å; M90-F95 HydrophobicContact SD-CB 4.4Å; L93-F95 PolarHBondContact O-N 3.25Å; F95-V97 PolarHBondContact O-N 2.89Å; F95-G98 PolarHBondContact O-N 3Å; F95-A99 HydrophobicContact CE1-CB 4.32Å; F95-A99 VanDerWaalsContact O-CB 3.28Å; F95-A99 WeakPolarHBondContact O-CB 3.49Å; F95-A99 PolarHBondContact O-N 2.98Å; F95-I141 HydrophobicContact CB-CG1 4.34Å; F95-I141 HydrophobicContact CD2-CG1 4.3Å; F95-I141 HydrophobicContact CD2-CG2 3.85Å; F95-I141 HydrophobicContact CE2-CG2 4.31Å; F95-M145 HydrophobicContact CB-CE 4.48Å; F95-M145 HydrophobicContact CD2-CE 3.23Å; F95-M145 HydrophobicContact CE2-CE 3.43Å; F95-M145 VanDerWaalsContact CE2-CE 3.43Å; F95-M145 HydrophobicContact CG-CE 3.84Å; F95-M145 HydrophobicContact CZ-CE 4.21Å; F95-M210 WeakPolarHBondContact CE1-O 3.18Å; F95-G214 VanDerWaalsContact CD1-CA 3.43Å; F95-G214 VanDerWaalsContact CE1-N 3.33Å; F95-L217 HydrophobicContact CE2-CD2 4.22Å; F95-L217 HydrophobicContact CZ-CD2 4.22Å
96P98.3Very high97.9Very high0 Ų020.5 Ų20.50%09%0.091CC..Hα-helixtrans-64.6-38.6-173.224.6-35000112.8A91 V92 F100 V162 I207 M210A91-P96 VanDerWaalsContact O-CD 3.28Å; A91-P96 WeakPolarHBondContact O-CD 3.48Å; A91-P96 WeakPolarHBondContact O-CG 3.24Å; V92-P96 VanDerWaalsContact C-CG 3.45Å; V92-P96 VanDerWaalsContact O-CG 3.25Å; V92-P96 WeakPolarHBondContact O-CG 3.26Å; P96-F100 WeakPolarHBondContact O-CB 3.44Å; P96-F100 PolarHBondContact O-N 2.91Å; P96-V162 HydrophobicContact CB-CG2 4.35Å; P96-V162 HydrophobicContact CG-CG2 3.99Å; P96-I207 HydrophobicContact CB-CG1 4.35Å; P96-M210 HydrophobicContact CB-CB 4.41Å
97V98.5Very high97.9Very high1 Ų122.9 Ų22.91%0.00611%0.108CC..Hα-helixtrans-70.4-45.8177.9-177.50000110.4L42 D46 L93 F95 F100 V101 F165 I207L42-V97 HydrophobicContact CD1-CG1 4.27Å; D46-V97 HydrophobicContact CB-CG1 3.99Å; L93-V97 WeakPolarHBondContact O-CB 3.48Å; L93-V97 WeakPolarHBondContact O-CG2 3.39Å; L93-V97 PolarHBondContact O-N 3.12Å; F95-V97 PolarHBondContact O-N 2.89Å; V97-F100 WeakPolarHBondContact O-CB 3.46Å; V97-F100 PolarHBondContact O-N 3.13Å; V97-V101 HydrophobicContact CG1-CG2 4.34Å; V97-V101 WeakPolarHBondContact O-CG2 3.46Å; V97-V101 PolarHBondContact O-N 3.37Å; V97-F165 HydrophobicContact CB-CE1 4.43Å; V97-F165 HydrophobicContact CG1-CE1 4.06Å; V97-F165 HydrophobicContact CG1-CZ 4.32Å; V97-F165 HydrophobicContact CG2-CD1 3.81Å; V97-F165 HydrophobicContact CG2-CE1 3.42Å; V97-F165 VanDerWaalsContact CG2-CE1 3.42Å; V97-F165 HydrophobicContact CG2-CZ 3.97Å; V97-I207 HydrophobicContact CG2-CD1 4.21Å
98G98.3Very high97.9Very high0 Ų024.1 Ų24.10%012%0.115CC..Hα-helixtrans-62.8-45.9179.600000112.9D46 A94 F95 F100 V101 V102D46-G98 WeakPolarHBondContact OD1-CA 3.27Å; D46-G98 PolarHBondContact OD1-N 3.28Å; A94-G98 PolarHBondContact O-N 3.09Å; F95-G98 PolarHBondContact O-N 3Å; G98-F100 VanDerWaalsContact C-N 3.33Å; G98-F100 PolarHBondContact O-N 3.39Å; G98-V101 PolarHBondContact O-N 3.48Å; G98-V102 WeakPolarHBondContact O-CG2 3.47Å; G98-V102 PolarHBondContact O-N 3.1Å; G98-V102 VanDerWaalsContact O-N 3.08Å
99A98.6Very high97.9Very high6 Ų620.9 Ų20.95%0.0510%0.103CC..Hα-helixtrans-62.6-41174.500000111.7F95 F103 L138 M210F95-A99 HydrophobicContact CE1-CB 4.32Å; F95-A99 VanDerWaalsContact O-CB 3.28Å; F95-A99 WeakPolarHBondContact O-CB 3.49Å; F95-A99 PolarHBondContact O-N 2.98Å; A99-F103 WeakPolarHBondContact O-CB 3.31Å; A99-F103 PolarHBondContact O-N 2.91Å; A99-L138 HydrophobicContact CB-CD1 4.06Å; A99-M210 HydrophobicContact CB-CB 4.28Å; A99-M210 HydrophobicContact CB-CG 4.23Å; A99-M210 HydrophobicContact CB-SD 4.01Å
100F98.5Very high97.9Very high20 Ų2026.5 Ų26.59%0.08813%0.133CC..Hα-helixtrans-62.3-47.9176.9175.2-90.1000112.3L42 P96 V97 G98 F103 T104 M203 V206 I207 M210L42-F100 HydrophobicContact CD2-CD1 3.77Å; L42-F100 HydrophobicContact CD2-CE1 3.62Å; P96-F100 WeakPolarHBondContact O-CB 3.44Å; P96-F100 PolarHBondContact O-N 2.91Å; V97-F100 WeakPolarHBondContact O-CB 3.46Å; V97-F100 PolarHBondContact O-N 3.13Å; G98-F100 VanDerWaalsContact C-N 3.33Å; G98-F100 PolarHBondContact O-N 3.39Å; F100-F103 PolarHBondContact O-N 3.22Å; F100-T104 HydrophobicContact CD1-CG2 4.4Å; F100-T104 HydrophobicContact CD2-CG2 3.95Å; F100-T104 HydrophobicContact CE1-CG2 4.09Å; F100-T104 HydrophobicContact CE2-CG2 3.6Å; F100-T104 HydrophobicContact CG-CG2 4.33Å; F100-T104 HydrophobicContact CZ-CG2 3.68Å; F100-T104 WeakPolarHBondContact O-CB 3.31Å; F100-T104 WeakPolarHBondContact O-CG2 3.31Å; F100-T104 PolarHBondContact O-N 2.87Å; F100-T104 PolarHBondContact O-OG1 2.92Å; F100-M203 HydrophobicContact CE2-CB 4.17Å; F100-M203 WeakPolarHBondContact CE2-O 3.45Å; F100-M203 HydrophobicContact CE2-SD 4.04Å; F100-M203 HydrophobicContact CZ-CB 3.96Å; F100-M203 HydrophobicContact CZ-CG 4.29Å; F100-M203 HydrophobicContact CZ-SD 3.84Å; F100-V206 HydrophobicContact CD2-CB 4.25Å; F100-V206 HydrophobicContact CD2-CG1 3.81Å; F100-V206 HydrophobicContact CE2-CB 4.08Å; F100-V206 HydrophobicContact CE2-CG1 4.01Å; F100-I207 HydrophobicContact CB-CB 4.46Å; F100-I207 HydrophobicContact CB-CG1 4.12Å; F100-I207 HydrophobicContact CD2-CB 3.7Å; F100-I207 HydrophobicContact CD2-CG1 4.25Å; F100-I207 HydrophobicContact CE2-CB 4.21Å; F100-I207 HydrophobicContact CG-CB 4.18Å; F100-I207 HydrophobicContact CG-CD1 4.49Å; F100-I207 HydrophobicContact CG-CG1 4.23Å; F100-M210 HydrophobicContact CB-CG 4.33Å
101V98.2Very high97.8Very high3 Ų335.8 Ų35.82%0.01817%0.169CC..Hα-helixtrans-59.9-49.7178.8167.10000110.3L42 T43 D46 V97 G98 T104 F105L42-V101 HydrophobicContact CB-CG2 4.5Å; L42-V101 HydrophobicContact CD2-CG2 3.92Å; L42-V101 HydrophobicContact CG-CG2 3.8Å; T43-V101 HydrophobicContact CG2-CG1 4.33Å; D46-V101 HydrophobicContact CB-CG2 3.98Å; V97-V101 HydrophobicContact CG1-CG2 4.34Å; V97-V101 WeakPolarHBondContact O-CG2 3.46Å; V97-V101 PolarHBondContact O-N 3.37Å; G98-V101 PolarHBondContact O-N 3.48Å; V101-T104 PolarHBondContact O-OG1 3.43Å; V101-F105 WeakPolarHBondContact O-CB 3.37Å; V101-F105 PolarHBondContact O-N 3.02Å
102V98.5Very high97.8Very high15 Ų1538.3 Ų38.39%0.09118%0.182CC..Hα-helixtrans-60.1-50.8179.2173.90000110.4G98 W106 H134 V137 L138G98-V102 WeakPolarHBondContact O-CG2 3.47Å; G98-V102 PolarHBondContact O-N 3.1Å; G98-V102 VanDerWaalsContact O-N 3.08Å; V102-W106 PolarHBondContact O-N 3.03Å; V102-W106 VanDerWaalsContact O-N 3.12Å; V102-H134 VanDerWaalsContact CG2-O 3.31Å; V102-H134 WeakPolarHBondContact CG2-O 3.35Å; V102-V137 HydrophobicContact CG2-CB 4.07Å; V102-L138 HydrophobicContact CB-CB 4.34Å; V102-L138 HydrophobicContact CG1-CB 4.16Å; V102-L138 HydrophobicContact CG1-CD2 4.16Å; V102-L138 HydrophobicContact CG2-CB 3.95Å
103F98.4Very high97.8Very high100 Ų10040 Ų4044%0.43919%0.188SC..Hα-helixtrans-61.3-52.1-177.6175.5-102.3000112.1A99 F100 T107 V206 M210A99-F103 WeakPolarHBondContact O-CB 3.31Å; A99-F103 PolarHBondContact O-N 2.91Å; F100-F103 PolarHBondContact O-N 3.22Å; F103-T107 VanDerWaalsContact O-CB 3.23Å; F103-T107 WeakPolarHBondContact O-CB 3.41Å; F103-T107 PolarHBondContact O-N 3.4Å; F103-T107 PolarHBondContact O-OG1 3.36Å; F103-V206 HydrophobicContact CD1-CG1 3.88Å; F103-V206 HydrophobicContact CE1-CG1 3.99Å; F103-M210 HydrophobicContact CD1-CE 4.18Å; F103-M210 HydrophobicContact CG-CE 4.18Å
104T97.8Very high97.8Very high22 Ų2240.9 Ų40.914%0.13519%0.192CC..Hα-helixtrans-69.4-40.7-176.155.50000112.1F100 V101 L108 M203F100-T104 HydrophobicContact CD1-CG2 4.4Å; F100-T104 HydrophobicContact CD2-CG2 3.95Å; F100-T104 HydrophobicContact CE1-CG2 4.09Å; F100-T104 HydrophobicContact CE2-CG2 3.6Å; F100-T104 HydrophobicContact CG-CG2 4.33Å; F100-T104 HydrophobicContact CZ-CG2 3.68Å; F100-T104 WeakPolarHBondContact O-CB 3.31Å; F100-T104 WeakPolarHBondContact O-CG2 3.31Å; F100-T104 PolarHBondContact O-N 2.87Å; F100-T104 PolarHBondContact O-OG1 2.92Å; V101-T104 PolarHBondContact O-OG1 3.43Å; T104-L108 WeakPolarHBondContact O-CB 3.36Å; T104-L108 WeakPolarHBondContact O-CG 3.35Å; T104-L108 PolarHBondContact O-N 3.41Å; T104-M203 HydrophobicContact CG2-SD 3.84Å
105F98.2Very high97.6Very high7 Ų741.7 Ų41.73%0.03120%0.196CC..Hα-helixtrans-59.3-56177.2178-93.3000111V101 T107 L108 Y109 V116 Y117 N130 H134V101-F105 WeakPolarHBondContact O-CB 3.37Å; V101-F105 PolarHBondContact O-N 3.02Å; F105-T107 VanDerWaalsContact C-N 3.34Å; F105-T107 PolarHBondContact O-N 2.92Å; F105-L108 PolarHBondContact O-N 3.03Å; F105-Y109 AromaticContact CE1-CD2 3.9Å; F105-Y109 HydrophobicContact CE1-CD2 3.9Å; F105-Y109 HydrophobicContact CE1-CG 4.29Å; F105-Y109 HydrophobicContact CE2-CD2 4.47Å; F105-Y109 AromaticContact CZ-CD2 3.71Å; F105-Y109 HydrophobicContact CZ-CD2 3.71Å; F105-Y109 HydrophobicContact CZ-CE2 4.3Å; F105-Y109 WeakPolarHBondContact O-CB 3.45Å; F105-Y109 PolarHBondContact O-N 3.45Å; F105-V116 HydrophobicContact CD2-CG1 4.29Å; F105-V116 HydrophobicContact CD2-CG2 4.02Å; F105-V116 HydrophobicContact CE2-CG1 4.43Å; F105-Y117 HydrophobicContact CE2-CD2 4.15Å; F105-Y117 HydrophobicContact CE2-CG 4.18Å; F105-Y117 HydrophobicContact CZ-CD2 4.3Å; F105-Y117 HydrophobicContact CZ-CG 4.19Å; F105-N130 WeakPolarHBondContact CZ-OD1 3.46Å; F105-H134 HydrophobicContact CB-CB 4.5Å; F105-H134 HydrophobicContact CD1-CB 3.43Å; F105-H134 VanDerWaalsContact CD1-CB 3.43Å; F105-H134 AromaticContact CD1-CD2 3.83Å; F105-H134 AromaticContact CD1-CG 3.58Å; F105-H134 HydrophobicContact CD2-CB 4.47Å; F105-H134 AromaticContact CD2-CD2 3.25Å; F105-H134 WeakPolarHBondContact CD2-CD2 3.47Å; F105-H134 AromaticContact CD2-CE1 3.88Å; F105-H134 AromaticContact CD2-CG 3.74Å; F105-H134 AromaticContact CD2-NE2 3.37Å; F105-H134 WeakPolarHBondContact CD2-NE2 3.33Å; F105-H134 HydrophobicContact CE1-CB 3.62Å; F105-H134 AromaticContact CE1-CG 3.61Å; F105-H134 AromaticContact CE1-ND1 3.83Å; F105-H134 AromaticContact CE2-CD2 3.61Å; F105-H134 AromaticContact CE2-CE1 3.43Å; F105-H134 VanDerWaalsContact CE2-CE1 3.43Å; F105-H134 WeakPolarHBondContact CE2-CE1 3.06Å; F105-H134 AromaticContact CE2-CG 3.75Å; F105-H134 AromaticContact CE2-ND1 3.66Å; F105-H134 AromaticContact CE2-NE2 3.41Å; F105-H134 WeakPolarHBondContact CE2-NE2 3.44Å; F105-H134 HydrophobicContact CG-CB 3.89Å; F105-H134 AromaticContact CG-CD2 3.35Å; F105-H134 WeakPolarHBondContact CG-CD2 3.36Å; F105-H134 AromaticContact CG-CG 3.64Å; F105-H134 AromaticContact CG-NE2 4Å; F105-H134 HydrophobicContact CZ-CB 4.21Å; F105-H134 AromaticContact CZ-CE1 3.74Å; F105-H134 AromaticContact CZ-CG 3.69Å; F105-H134 AromaticContact CZ-ND1 3.51Å
106W98.2Very high97.5Very high52 Ų5242.6 Ų42.620%0.19720%0.202CC..Hα-helixtrans-68.6-34-176.4-70.8110.5000112.5V102 Y109 L110 H131 H134 T135V102-W106 PolarHBondContact O-N 3.03Å; V102-W106 VanDerWaalsContact O-N 3.12Å; W106-Y109 HydrophobicContact CE3-CD1 4.14Å; W106-Y109 HydrophobicContact CE3-CG 4.26Å; W106-Y109 AromaticContact CZ3-CD1 3.99Å; W106-Y109 HydrophobicContact CZ3-CD1 3.99Å; W106-Y109 HydrophobicContact CZ3-CE1 4.23Å; W106-Y109 HydrophobicContact CZ3-CG 4.25Å; W106-Y109 PolarHBondContact O-N 3.28Å; W106-L110 VanDerWaalsContact O-CB 3.28Å; W106-L110 WeakPolarHBondContact O-CB 3.48Å; W106-L110 WeakPolarHBondContact O-CG 3.29Å; W106-L110 PolarHBondContact O-N 3.23Å; W106-H131 AromaticContact CH2-CE1 3.47Å; W106-H131 VanDerWaalsContact CH2-CE1 3.47Å; W106-H131 WeakPolarHBondContact CH2-CE1 3.37Å; W106-H131 AromaticContact CH2-ND1 3.75Å; W106-H131 AromaticContact CZ2-CE1 3.82Å; W106-H131 AromaticContact CZ2-ND1 3.63Å; W106-H134 HydrophobicContact CZ2-CB 4.21Å; W106-H134 PolarHBondContact NE1-O 3.32Å; W106-T135 WeakPolarHBondContact CZ2-OG1 3.35Å; W106-T135 PolarHBondContact NE1-OG1 3.41Å
107T97.8Very high97.3Very high71 Ų7142.8 Ų42.844%0.43620%0.203SC..Hα-helixtrans-60.7-50.4174.4-600000111.1F103 F105 Y111F103-T107 VanDerWaalsContact O-CB 3.23Å; F103-T107 WeakPolarHBondContact O-CB 3.41Å; F103-T107 PolarHBondContact O-N 3.4Å; F103-T107 PolarHBondContact O-OG1 3.36Å; F105-T107 VanDerWaalsContact C-N 3.34Å; F105-T107 PolarHBondContact O-N 2.92Å; T107-Y111 WeakPolarHBondContact O-CB 3.27Å; T107-Y111 PolarHBondContact O-N 2.91Å; T107-Y111 VanDerWaalsContact O-N 3.12Å
108L96.7Very high97.1Very high33 Ų3344.2 Ų44.217%0.17321%0.212CC..Hα-helixtrans-68.7-40.1178.4-69.9174.2000111.7T104 F105 L110 Y111 D112 L115 V116T104-L108 WeakPolarHBondContact O-CB 3.36Å; T104-L108 WeakPolarHBondContact O-CG 3.35Å; T104-L108 PolarHBondContact O-N 3.41Å; F105-L108 PolarHBondContact O-N 3.03Å; L108-L110 PolarHBondContact O-N 2.99Å; L108-Y111 PolarHBondContact O-N 3.14Å; L108-D112 CarbonylContact O-C 3.58Å; L108-D112 PolarHBondContact O-N 3.39Å; L108-L115 HydrophobicContact CD2-CD1 4.33Å; L108-V116 HydrophobicContact CB-CB 4.11Å; L108-V116 HydrophobicContact CB-CG1 3.77Å; L108-V116 HydrophobicContact CD1-CB 4.24Å
109Y97.1Very high96.9Very high46 Ų4650.7 Ų50.718%0.1824%0.24CC..Hα-helixtrans-59-45.6178.7-172.4-78.4000111.9F105 W106 R113 Y117F105-Y109 AromaticContact CE1-CD2 3.9Å; F105-Y109 HydrophobicContact CE1-CD2 3.9Å; F105-Y109 HydrophobicContact CE1-CG 4.29Å; F105-Y109 HydrophobicContact CE2-CD2 4.47Å; F105-Y109 AromaticContact CZ-CD2 3.71Å; F105-Y109 HydrophobicContact CZ-CD2 3.71Å; F105-Y109 HydrophobicContact CZ-CE2 4.3Å; F105-Y109 WeakPolarHBondContact O-CB 3.45Å; F105-Y109 PolarHBondContact O-N 3.45Å; W106-Y109 HydrophobicContact CE3-CD1 4.14Å; W106-Y109 HydrophobicContact CE3-CG 4.26Å; W106-Y109 AromaticContact CZ3-CD1 3.99Å; W106-Y109 HydrophobicContact CZ3-CD1 3.99Å; W106-Y109 HydrophobicContact CZ3-CE1 4.23Å; W106-Y109 HydrophobicContact CZ3-CG 4.25Å; W106-Y109 PolarHBondContact O-N 3.28Å; Y109-R113 HydrophobicContact CD1-CB 4.45Å; Y109-R113 HydrophobicContact CD2-CB 3.9Å; Y109-R113 HydrophobicContact CE2-CB 4.06Å; Y109-R113 HydrophobicContact CG-CB 4.1Å; Y109-R113 PolarHBondContact O-N 3.47Å; Y109-Y117 HydrophobicContact CD2-CD1 4.17Å; Y109-Y117 HydrophobicContact CD2-CG 4.41Å; Y109-Y117 AromaticContact CE2-CD1 3.58Å; Y109-Y117 HydrophobicContact CE2-CD1 3.58Å; Y109-Y117 HydrophobicContact CE2-CE1 4.24Å; Y109-Y117 HydrophobicContact CE2-CG 4.24Å
110L97.4Very high96.6Very high139 Ų13955.9 Ų55.973%0.72827%0.267SS*.Hα-helixtrans-73.2-31.5179.7-68.9171.2000112.6W106 L108W106-L110 VanDerWaalsContact O-CB 3.28Å; W106-L110 WeakPolarHBondContact O-CB 3.48Å; W106-L110 WeakPolarHBondContact O-CG 3.29Å; W106-L110 PolarHBondContact O-N 3.23Å; L108-L110 PolarHBondContact O-N 2.99Å
111Y96.8Very high96.2Very high194 Ų19457 Ų5776%0.76127%0.273SS*.Hα-helixtrans-73.8-57.9176.8178.9-98.6000112.2T107 L108 L115T107-Y111 WeakPolarHBondContact O-CB 3.27Å; T107-Y111 PolarHBondContact O-N 2.91Å; T107-Y111 VanDerWaalsContact O-N 3.12Å; L108-Y111 PolarHBondContact O-N 3.14Å; Y111-L115 HydrophobicContact CD1-CD1 3.85Å; Y111-L115 HydrophobicContact CE1-CD1 4.16Å
112D96.9Very high96Very high53 Ų5359.6 Ų59.628%0.28329%0.287SS..Hα-helixtrans-157.7102.9170.517312.8000108.3L108 E114 L115 R190L108-D112 CarbonylContact O-C 3.58Å; L108-D112 PolarHBondContact O-N 3.39Å; D112-E114 PolarHBondContact O-N 3.21Å; D112-E114 WeakPolarHBondContact OD1-CB 3.42Å; D112-E114 PolarHBondContact OD1-N 2.88Å; D112-L115 HydrophobicContact CB-CD1 3.95Å; D112-L115 HydrophobicContact CB-CG 3.99Å; D112-L115 VanDerWaalsContact O-CB 3.27Å; D112-L115 WeakPolarHBondContact O-CB 3.39Å; D112-L115 WeakPolarHBondContact O-CG 3.42Å; D112-L115 PolarHBondContact O-N 3.45Å; D112-R190 IonicContact OD2-NH1 2.74Å; D112-R190 PolarHBondContact OD2-NH1 2.96Å
113R95.8Very high95.7Very high37 Ų3765 Ų6514%0.1432%0.315CS..G310 helixtrans-56.1-26.5-17967.4171-72.4-175.7-4.7114.1Y109 L115 V116 Y117 P118 D122Y109-R113 HydrophobicContact CD1-CB 4.45Å; Y109-R113 HydrophobicContact CD2-CB 3.9Å; Y109-R113 HydrophobicContact CE2-CB 4.06Å; Y109-R113 HydrophobicContact CG-CB 4.1Å; Y109-R113 PolarHBondContact O-N 3.47Å; R113-L115 PolarHBondContact O-N 3.48Å; R113-V116 PolarHBondContact O-N 3.23Å; R113-V116 VanDerWaalsContact O-N 3.17Å; R113-Y117 PolarHBondContact NE-O 2.94Å; R113-Y117 PolarHBondContact NH2-O 3.31Å; R113-Y117 CarbonylContact O-C 3.07Å; R113-Y117 WeakPolarHBondContact O-CA 3.24Å; R113-Y117 PolarHBondContact O-N 3.34Å; R113-Y117 VanDerWaalsContact O-O 3.04Å; R113-P118 PolarHBondContact NH2-O 3.48Å; R113-D122 IonicContact CZ-OD1 2.97Å; R113-D122 IonicContact CZ-OD2 3.64Å; R113-D122 VanDerWaalsContact CZ-OD2 3.28Å; R113-D122 IonicContact NH1-OD1 3.28Å; R113-D122 IonicContact NH1-OD2 3.57Å; R113-D122 PolarHBondContact NH1-OD2 3.07Å; R113-D122 IonicContact NH2-OD1 3.72Å; R113-D122 PolarHBondContact NH2-OD1 3.38Å; R113-D122 IonicContact NH2-OD2 3.65Å; R113-D122 PolarHBondContact NH2-OD2 3.01Å
114E96.8Very high95.5Very high50 Ų5063.4 Ų63.423%0.23431%0.308CS..G310 helixtrans-65.3-12.5179.3-63.9-66148.600112.9D112 P118 K119 P186 R190D112-E114 PolarHBondContact O-N 3.21Å; D112-E114 WeakPolarHBondContact OD1-CB 3.42Å; D112-E114 PolarHBondContact OD1-N 2.88Å; E114-P118 WeakPolarHBondContact OE2-CA 3.44Å; E114-P118 WeakPolarHBondContact OE2-CB 3.38Å; E114-K119 WeakPolarHBondContact OE1-CB 3.48Å; E114-K119 WeakPolarHBondContact OE1-CD 3.2Å; E114-K119 WeakPolarHBondContact OE1-CG 3.48Å; E114-K119 PolarHBondContact OE1-N 2.96Å; E114-P186 VanDerWaalsContact O-CB 3.24Å; E114-P186 WeakPolarHBondContact O-CB 3.35Å; E114-R190 VanDerWaalsContact CB-NH2 3.32Å
115L95.7Very high95.3Very high18 Ų1862.8 Ų62.89%0.09430%0.304CS..G310 helixtrans-76.2-25.7176.3-63.9178.6000114.1L108 Y111 D112 R113 P186 V187L108-L115 HydrophobicContact CD2-CD1 4.33Å; Y111-L115 HydrophobicContact CD1-CD1 3.85Å; Y111-L115 HydrophobicContact CE1-CD1 4.16Å; D112-L115 HydrophobicContact CB-CD1 3.95Å; D112-L115 HydrophobicContact CB-CG 3.99Å; D112-L115 VanDerWaalsContact O-CB 3.27Å; D112-L115 WeakPolarHBondContact O-CB 3.39Å; D112-L115 WeakPolarHBondContact O-CG 3.42Å; D112-L115 PolarHBondContact O-N 3.45Å; R113-L115 PolarHBondContact O-N 3.48Å; L115-P186 WeakPolarHBondContact O-CD 3.47Å; L115-V187 HydrophobicContact CB-CB 4.14Å; L115-V187 HydrophobicContact CD2-CB 4.3Å; L115-V187 HydrophobicContact CD2-CG2 4.35Å; L115-V187 PolarHBondContact O-N 3.28Å
116V95.6Very high95.2Very high27 Ų2764.9 Ų64.916%0.16432%0.319CS..THydrogen-bonded Turntrans-135.2-32.6-172.967.90000113.1F105 L108 R113 Y185F105-V116 HydrophobicContact CD2-CG1 4.29Å; F105-V116 HydrophobicContact CD2-CG2 4.02Å; F105-V116 HydrophobicContact CE2-CG1 4.43Å; L108-V116 HydrophobicContact CB-CB 4.11Å; L108-V116 HydrophobicContact CB-CG1 3.77Å; L108-V116 HydrophobicContact CD1-CB 4.24Å; R113-V116 PolarHBondContact O-N 3.23Å; R113-V116 VanDerWaalsContact O-N 3.17Å; V116-Y185 HydrophobicContact CG2-CD1 4.38Å
117Y94.6Very high95Very high5 Ų566.8 Ų66.82%0.0233%0.33CS..SBendtrans-142.578.3-175-171.1-96.4000110.9F105 Y109 R113 L121 D122 I125F105-Y117 HydrophobicContact CE2-CD2 4.15Å; F105-Y117 HydrophobicContact CE2-CG 4.18Å; F105-Y117 HydrophobicContact CZ-CD2 4.3Å; F105-Y117 HydrophobicContact CZ-CG 4.19Å; Y109-Y117 HydrophobicContact CD2-CD1 4.17Å; Y109-Y117 HydrophobicContact CD2-CG 4.41Å; Y109-Y117 AromaticContact CE2-CD1 3.58Å; Y109-Y117 HydrophobicContact CE2-CD1 3.58Å; Y109-Y117 HydrophobicContact CE2-CE1 4.24Å; Y109-Y117 HydrophobicContact CE2-CG 4.24Å; R113-Y117 PolarHBondContact NE-O 2.94Å; R113-Y117 PolarHBondContact NH2-O 3.31Å; R113-Y117 CarbonylContact O-C 3.07Å; R113-Y117 WeakPolarHBondContact O-CA 3.24Å; R113-Y117 PolarHBondContact O-N 3.34Å; R113-Y117 VanDerWaalsContact O-O 3.04Å; Y117-L121 HydrophobicContact CD2-CB 4.21Å; Y117-L121 HydrophobicContact CD2-CD1 3.46Å; Y117-L121 VanDerWaalsContact CD2-CD1 3.46Å; Y117-L121 HydrophobicContact CD2-CG 4.49Å; Y117-L121 HydrophobicContact CE1-CB 4.28Å; Y117-L121 HydrophobicContact CE2-CB 3.71Å; Y117-L121 HydrophobicContact CE2-CD1 3.71Å; Y117-L121 HydrophobicContact CE2-CG 4.37Å; Y117-L121 HydrophobicContact CG-CD1 4.06Å; Y117-D122 WeakPolarHBondContact CE1-OD1 3.38Å; Y117-D122 PolarHBondContact OH-OD1 3.39Å; Y117-I125 HydrophobicContact CE2-CD1 3.94Å; Y117-I125 WeakPolarHBondContact OH-CB 3.43Å
118P93.8Very high94.9Very high31 Ų3169.5 Ų69.520%0.20133%0.332CS..  trans-54.7149.3179.4-27.536.4000113.1R113 E114 L120 L121 P186R113-P118 PolarHBondContact NH2-O 3.48Å; E114-P118 WeakPolarHBondContact OE2-CA 3.44Å; E114-P118 WeakPolarHBondContact OE2-CB 3.38Å; P118-L120 PolarHBondContact O-N 2.96Å; P118-L120 VanDerWaalsContact O-N 3.08Å; P118-L121 WeakPolarHBondContact O-CB 3.47Å; P118-L121 PolarHBondContact O-N 3.03Å; P118-P186 HydrophobicContact CG-CG 3.91Å
119K93.6Very high94.9Very high135 Ų13568 Ų6859%0.58732%0.324SS*.G310 helixtrans-54.8-28.7177.4-76.4166.9-171.1178.80114E114 L121 D122E114-K119 WeakPolarHBondContact OE1-CB 3.48Å; E114-K119 WeakPolarHBondContact OE1-CD 3.2Å; E114-K119 WeakPolarHBondContact OE1-CG 3.48Å; E114-K119 PolarHBondContact OE1-N 2.96Å; K119-L121 PolarHBondContact O-N 2.81Å; K119-L121 VanDerWaalsContact O-N 3.14Å; K119-D122 WeakPolarHBondContact O-CB 3.49Å; K119-D122 PolarHBondContact O-N 3.2Å
120L91.4Very high94.9Very high116 Ų11665.8 Ų65.861%0.60732%0.316SS*.G310 helixtrans-54.3-32.5175.5-179.263.4000112.7P118 D122 N123 F124P118-L120 PolarHBondContact O-N 2.96Å; P118-L120 VanDerWaalsContact O-N 3.08Å; L120-D122 PolarHBondContact O-N 2.89Å; L120-N123 PolarHBondContact O-N 3.45Å; L120-N123 PolarHBondContact O-ND2 3.44Å; L120-F124 HydrophobicContact CD1-CE2 4.39Å; L120-F124 HydrophobicContact CG-CE2 4.36Å; L120-F124 WeakPolarHBondContact O-CD2 3.39Å
121L91.6Very high94.8Very high43 Ų4363.1 Ų63.123%0.22530%0.299CS..G310 helixtrans-68.4-21.8-179.8-65.5178.5000113.1M29 Y117 P118 K119 N123 F124 I125M29-L121 HydrophobicContact SD-CD2 4.47Å; Y117-L121 HydrophobicContact CD2-CB 4.21Å; Y117-L121 HydrophobicContact CD2-CD1 3.46Å; Y117-L121 VanDerWaalsContact CD2-CD1 3.46Å; Y117-L121 HydrophobicContact CD2-CG 4.49Å; Y117-L121 HydrophobicContact CE1-CB 4.28Å; Y117-L121 HydrophobicContact CE2-CB 3.71Å; Y117-L121 HydrophobicContact CE2-CD1 3.71Å; Y117-L121 HydrophobicContact CE2-CG 4.37Å; Y117-L121 HydrophobicContact CG-CD1 4.06Å; P118-L121 WeakPolarHBondContact O-CB 3.47Å; P118-L121 PolarHBondContact O-N 3.03Å; K119-L121 PolarHBondContact O-N 2.81Å; K119-L121 VanDerWaalsContact O-N 3.14Å; L121-N123 PolarHBondContact O-N 2.89Å; L121-F124 PolarHBondContact O-N 3Å; L121-I125 HydrophobicContact CB-CD1 4.37Å; L121-I125 PolarHBondContact O-N 2.81Å
122D93.1Very high94.8Very high58 Ų5854.1 Ų54.131%0.3127%0.265SS..G310 helixtrans-64.3-22.6177.6-66.8-17.3000112.5R113 Y117 K119 L120 F124R113-D122 IonicContact CZ-OD1 2.97Å; R113-D122 IonicContact CZ-OD2 3.64Å; R113-D122 VanDerWaalsContact CZ-OD2 3.28Å; R113-D122 IonicContact NH1-OD1 3.28Å; R113-D122 IonicContact NH1-OD2 3.57Å; R113-D122 PolarHBondContact NH1-OD2 3.07Å; R113-D122 IonicContact NH2-OD1 3.72Å; R113-D122 PolarHBondContact NH2-OD1 3.38Å; R113-D122 IonicContact NH2-OD2 3.65Å; R113-D122 PolarHBondContact NH2-OD2 3.01Å; Y117-D122 WeakPolarHBondContact CE1-OD1 3.38Å; Y117-D122 PolarHBondContact OH-OD1 3.39Å; K119-D122 WeakPolarHBondContact O-CB 3.49Å; K119-D122 PolarHBondContact O-N 3.2Å; L120-D122 PolarHBondContact O-N 2.89Å; D122-F124 PolarHBondContact O-N 3.37Å
123N93.5Very high94.8Very high127 Ų12751.9 Ų51.968%0.67925%0.253SS*.G310 helixtrans-72.8-16.9175.7-63.3-37.6000113L120 L121L120-N123 PolarHBondContact O-N 3.45Å; L120-N123 PolarHBondContact O-ND2 3.44Å; L121-N123 PolarHBondContact O-N 2.89Å
124F92.8Very high94.9Very high67 Ų6750.5 Ų50.529%0.29425%0.249SC..THydrogen-bonded Turntrans-117.2-42-175-57.6-85.7000112.2L27 M29 L120 L121 D122 P126L27-F124 WeakPolarHBondContact CD1-O 3.24Å; L27-F124 VanDerWaalsContact CD2-O 3.25Å; L27-F124 WeakPolarHBondContact CD2-O 3.43Å; M29-F124 HydrophobicContact CG-CB 3.59Å; M29-F124 HydrophobicContact CG-CD1 3.83Å; M29-F124 HydrophobicContact CG-CG 3.75Å; M29-F124 HydrophobicContact SD-CB 3.6Å; M29-F124 HydrophobicContact SD-CG 4.2Å; L120-F124 HydrophobicContact CD1-CE2 4.39Å; L120-F124 HydrophobicContact CG-CE2 4.36Å; L120-F124 WeakPolarHBondContact O-CD2 3.39Å; L121-F124 PolarHBondContact O-N 3Å; D122-F124 PolarHBondContact O-N 3.37Å; F124-P126 WeakPolarHBondContact O-CD 3.34Å
125I94.3Very high94.9Very high9 Ų950.4 Ų50.45%0.04625%0.252CS..SBendtrans-103.5107.9-172.4-60.7169.6000108.6L27 M29 Y117 L121 L129 N130 M133L27-I125 HydrophobicContact CD1-CB 4.46Å; L27-I125 HydrophobicContact CD1-CG1 3.72Å; M29-I125 HydrophobicContact CE-CD1 4.13Å; M29-I125 HydrophobicContact CE-CG1 4.25Å; M29-I125 HydrophobicContact SD-CD1 3.85Å; M29-I125 HydrophobicContact SD-CG1 3.74Å; Y117-I125 HydrophobicContact CE2-CD1 3.94Å; Y117-I125 WeakPolarHBondContact OH-CB 3.43Å; L121-I125 HydrophobicContact CB-CD1 4.37Å; L121-I125 PolarHBondContact O-N 2.81Å; I125-L129 HydrophobicContact CG2-CB 4.27Å; I125-L129 HydrophobicContact CG2-CD2 4.29Å; I125-L129 HydrophobicContact CG2-CG 4.33Å; I125-N130 HydrophobicContact CG2-CB 4.08Å; I125-M133 HydrophobicContact CD1-CE 4.26Å; I125-M133 HydrophobicContact CG2-CE 3.59Å
126P94.9Very high95Very high52 Ų5251.4 Ų51.434%0.33826%0.258SS..  trans-67.1153.3175.828.4-34.7000111.1F124 W128 L129 N130F124-P126 WeakPolarHBondContact O-CD 3.34Å; P126-W128 VanDerWaalsContact C-N 3.28Å; P126-W128 VanDerWaalsContact CG-NE1 3.34Å; P126-W128 PolarHBondContact O-N 2.86Å; P126-L129 HydrophobicContact CG-CB 3.92Å; P126-L129 WeakPolarHBondContact O-CB 3.28Å; P126-L129 PolarHBondContact O-N 2.96Å; P126-N130 PolarHBondContact O-N 3.5Å
127Q94.1Very high95Very high92 Ų9250.1 Ų50.143%0.4325%0.25SS..Hα-helixtrans-56.4-39-174.3-70.7-61.7-22.800113.8L129 N130 H131Q127-L129 VanDerWaalsContact C-N 3.26Å; Q127-L129 PolarHBondContact O-N 3.19Å; Q127-N130 PolarHBondContact O-N 3.26Å; Q127-H131 PolarHBondContact O-CD2 3.43Å; Q127-H131 VanDerWaalsContact O-CD2 3.3Å; Q127-H131 PolarHBondContact O-N 3.27Å
128W96.1Very high95.1Very high127 Ų12752.2 Ų52.248%0.48126%0.262SS..Hα-helixtrans-60.6-38.9177.576.3-99.7000111.5I20 H23 P126 H131 G132I20-W128 HydrophobicContact CG1-CZ3 4.44Å; H23-W128 HydrophobicContact CB-CH2 3.67Å; H23-W128 HydrophobicContact CB-CZ2 4.01Å; H23-W128 AromaticContact CD2-CH2 3.9Å; H23-W128 AromaticContact CD2-CZ2 3.67Å; H23-W128 AromaticContact CG-CH2 3.52Å; H23-W128 AromaticContact CG-CZ2 3.76Å; H23-W128 AromaticContact ND1-CH2 3.79Å; P126-W128 VanDerWaalsContact C-N 3.28Å; P126-W128 VanDerWaalsContact CG-NE1 3.34Å; P126-W128 PolarHBondContact O-N 2.86Å; W128-H131 PolarHBondContact O-N 3.25Å; W128-G132 PolarHBondContact O-N 3.48Å
129L96.6Very high95.3Very high1 Ų153.7 Ų53.71%0.00527%0.272CS..Hα-helixtrans-73.1-41179.8-176.963.4000109.6I20 H23 L27 I125 P126 Q127 H131 G132 M133I20-L129 HydrophobicContact CB-CD1 4.37Å; I20-L129 HydrophobicContact CG2-CD1 3.85Å; H23-L129 HydrophobicContact CB-CD1 4.31Å; L27-L129 HydrophobicContact CD1-CD2 3.71Å; L27-L129 HydrophobicContact CG-CD2 4.41Å; I125-L129 HydrophobicContact CG2-CB 4.27Å; I125-L129 HydrophobicContact CG2-CD2 4.29Å; I125-L129 HydrophobicContact CG2-CG 4.33Å; P126-L129 HydrophobicContact CG-CB 3.92Å; P126-L129 WeakPolarHBondContact O-CB 3.28Å; P126-L129 PolarHBondContact O-N 2.96Å; Q127-L129 VanDerWaalsContact C-N 3.26Å; Q127-L129 PolarHBondContact O-N 3.19Å; L129-H131 VanDerWaalsContact C-N 3.32Å; L129-H131 PolarHBondContact O-N 3.45Å; L129-G132 CarbonylContact O-C 3.13Å; L129-G132 PolarHBondContact O-N 2.77Å; L129-G132 VanDerWaalsContact O-N 3.12Å; L129-M133 HydrophobicContact CD1-CG 4.22Å; L129-M133 HydrophobicContact CD1-SD 4.44Å; L129-M133 HydrophobicContact CG-CE 4.09Å; L129-M133 HydrophobicContact CG-CG 4.32Å; L129-M133 HydrophobicContact CG-SD 4.14Å; L129-M133 WeakPolarHBondContact O-CB 3.46Å; L129-M133 WeakPolarHBondContact O-CG 3.39Å; L129-M133 PolarHBondContact O-N 3.27Å
130N96.4Very high95.5Very high0 Ų049.4 Ų49.40%025%0.253CS..Hα-helixtrans-55.1-47.9173.3-175.736.4000111.8F105 I125 P126 Q127 M133 H134F105-N130 WeakPolarHBondContact CZ-OD1 3.46Å; I125-N130 HydrophobicContact CG2-CB 4.08Å; P126-N130 PolarHBondContact O-N 3.5Å; Q127-N130 PolarHBondContact O-N 3.26Å; N130-M133 PolarHBondContact O-N 3.15Å; N130-H134 WeakPolarHBondContact O-CB 3.49Å; N130-H134 PolarHBondContact O-N 2.92Å; N130-H134 PolarHBondContact O-ND1 3.27Å; N130-H134 VanDerWaalsContact O-ND1 3.13Å; N130-H134 PolarHBondContact OD1-CE1 3.29Å; N130-H134 PolarHBondContact OD1-ND1 2.88Å
131H97.3Very high95.7Very high83 Ų8343.9 Ų43.938%0.38422%0.224SC..Hα-helixtrans-66.3-37.5174.7-79.4-68.6000113.1W106 Q127 W128 L129 M133 H134 T135 T136W106-H131 AromaticContact CH2-CE1 3.47Å; W106-H131 VanDerWaalsContact CH2-CE1 3.47Å; W106-H131 WeakPolarHBondContact CH2-CE1 3.37Å; W106-H131 AromaticContact CH2-ND1 3.75Å; W106-H131 AromaticContact CZ2-CE1 3.82Å; W106-H131 AromaticContact CZ2-ND1 3.63Å; Q127-H131 PolarHBondContact O-CD2 3.43Å; Q127-H131 VanDerWaalsContact O-CD2 3.3Å; Q127-H131 PolarHBondContact O-N 3.27Å; W128-H131 PolarHBondContact O-N 3.25Å; L129-H131 VanDerWaalsContact C-N 3.32Å; L129-H131 PolarHBondContact O-N 3.45Å; H131-M133 PolarHBondContact O-N 2.95Å; H131-H134 PolarHBondContact O-N 3.27Å; H131-T135 PolarHBondContact ND1-OG1 3.5Å; H131-T135 WeakPolarHBondContact O-CA 3.4Å; H131-T135 VanDerWaalsContact O-CB 3.26Å; H131-T135 WeakPolarHBondContact O-CB 3.22Å; H131-T135 PolarHBondContact O-N 2.85Å; H131-T136 PolarHBondContact O-N 2.9Å; H131-T136 VanDerWaalsContact O-N 3.1Å
132G96.8Very high95.9Very high5 Ų544.5 Ų44.55%0.05223%0.227CC..Hα-helixtrans-61.4-32.9173.300000113W128 L129 T136W128-G132 PolarHBondContact O-N 3.48Å; L129-G132 CarbonylContact O-C 3.13Å; L129-G132 PolarHBondContact O-N 2.77Å; L129-G132 VanDerWaalsContact O-N 3.12Å; G132-T136 WeakPolarHBondContact CA-OG1 3.18Å; G132-T136 PolarHBondContact O-OG1 2.96Å
133M96.9Very high96Very high6 Ų644.8 Ų44.83%0.0323%0.228CC..Hα-helixtrans-84.4-33.1179.6-64.4-174.5-58.900113.2I20 Y24 T43 L47 I125 L129 N130 H131I20-M133 HydrophobicContact CG2-CG 3.87Å; Y24-M133 HydrophobicContact CD2-CE 4.32Å; Y24-M133 HydrophobicContact CD2-SD 3.38Å; Y24-M133 WeakPolarHBondContact CD2-SD 3.42Å; Y24-M133 HydrophobicContact CE2-SD 3.8Å; Y24-M133 HydrophobicContact CG-SD 4.06Å; T43-M133 HydrophobicContact CG2-CB 3.79Å; L47-M133 HydrophobicContact CD1-CB 4.04Å; L47-M133 HydrophobicContact CD1-CG 3.66Å; L47-M133 HydrophobicContact CD1-SD 4.32Å; I125-M133 HydrophobicContact CD1-CE 4.26Å; I125-M133 HydrophobicContact CG2-CE 3.59Å; L129-M133 HydrophobicContact CD1-CG 4.22Å; L129-M133 HydrophobicContact CD1-SD 4.44Å; L129-M133 HydrophobicContact CG-CE 4.09Å; L129-M133 HydrophobicContact CG-CG 4.32Å; L129-M133 HydrophobicContact CG-SD 4.14Å; L129-M133 WeakPolarHBondContact O-CB 3.46Å; L129-M133 WeakPolarHBondContact O-CG 3.39Å; L129-M133 PolarHBondContact O-N 3.27Å; N130-M133 PolarHBondContact O-N 3.15Å; H131-M133 PolarHBondContact O-N 2.95Å
134H97.2Very high96.1Very high9 Ų938.8 Ų38.84%0.04220%0.196CC..Hα-helixtrans-120.8-8.4-168.2-58.9105.3000115.3T43 V102 F105 W106 N130 H131T43-H134 WeakPolarHBondContact CG2-NE2 3.34Å; T43-H134 PolarHBondContact OG1-NE2 2.87Å; V102-H134 VanDerWaalsContact CG2-O 3.31Å; V102-H134 WeakPolarHBondContact CG2-O 3.35Å; F105-H134 HydrophobicContact CB-CB 4.5Å; F105-H134 HydrophobicContact CD1-CB 3.43Å; F105-H134 VanDerWaalsContact CD1-CB 3.43Å; F105-H134 AromaticContact CD1-CD2 3.83Å; F105-H134 AromaticContact CD1-CG 3.58Å; F105-H134 HydrophobicContact CD2-CB 4.47Å; F105-H134 AromaticContact CD2-CD2 3.25Å; F105-H134 WeakPolarHBondContact CD2-CD2 3.47Å; F105-H134 AromaticContact CD2-CE1 3.88Å; F105-H134 AromaticContact CD2-CG 3.74Å; F105-H134 AromaticContact CD2-NE2 3.37Å; F105-H134 WeakPolarHBondContact CD2-NE2 3.33Å; F105-H134 HydrophobicContact CE1-CB 3.62Å; F105-H134 AromaticContact CE1-CG 3.61Å; F105-H134 AromaticContact CE1-ND1 3.83Å; F105-H134 AromaticContact CE2-CD2 3.61Å; F105-H134 AromaticContact CE2-CE1 3.43Å; F105-H134 VanDerWaalsContact CE2-CE1 3.43Å; F105-H134 WeakPolarHBondContact CE2-CE1 3.06Å; F105-H134 AromaticContact CE2-CG 3.75Å; F105-H134 AromaticContact CE2-ND1 3.66Å; F105-H134 AromaticContact CE2-NE2 3.41Å; F105-H134 WeakPolarHBondContact CE2-NE2 3.44Å; F105-H134 HydrophobicContact CG-CB 3.89Å; F105-H134 AromaticContact CG-CD2 3.35Å; F105-H134 WeakPolarHBondContact CG-CD2 3.36Å; F105-H134 AromaticContact CG-CG 3.64Å; F105-H134 AromaticContact CG-NE2 4Å; F105-H134 HydrophobicContact CZ-CB 4.21Å; F105-H134 AromaticContact CZ-CE1 3.74Å; F105-H134 AromaticContact CZ-CG 3.69Å; F105-H134 AromaticContact CZ-ND1 3.51Å; W106-H134 HydrophobicContact CZ2-CB 4.21Å; W106-H134 PolarHBondContact NE1-O 3.32Å; N130-H134 WeakPolarHBondContact O-CB 3.49Å; N130-H134 PolarHBondContact O-N 2.92Å; N130-H134 PolarHBondContact O-ND1 3.27Å; N130-H134 VanDerWaalsContact O-ND1 3.13Å; N130-H134 PolarHBondContact OD1-CE1 3.29Å; N130-H134 PolarHBondContact OD1-ND1 2.88Å; H131-H134 PolarHBondContact O-N 3.27Å
135T97.2Very high96.2Very high48 Ų4835.6 Ų35.629%0.29418%0.182SC..THydrogen-bonded Turntrans-116.9-50179.4-53.20000111.6W106 H131 V137 L138 P139W106-T135 WeakPolarHBondContact CZ2-OG1 3.35Å; W106-T135 PolarHBondContact NE1-OG1 3.41Å; H131-T135 PolarHBondContact ND1-OG1 3.5Å; H131-T135 WeakPolarHBondContact O-CA 3.4Å; H131-T135 VanDerWaalsContact O-CB 3.26Å; H131-T135 WeakPolarHBondContact O-CB 3.22Å; H131-T135 PolarHBondContact O-N 2.85Å; T135-V137 PolarHBondContact O-N 2.87Å; T135-V137 VanDerWaalsContact O-N 3.16Å; T135-L138 PolarHBondContact O-N 3.38Å; T135-P139 WeakPolarHBondContact O-CD 3.34Å
136T96.3Very high96.1Very high38 Ų3842.4 Ų42.423%0.23321%0.207CC..THydrogen-bonded Turntrans-67.1-20.8-168.355.80000113.9H131 G132 L138 P139 F140H131-T136 PolarHBondContact O-N 2.9Å; H131-T136 VanDerWaalsContact O-N 3.1Å; G132-T136 WeakPolarHBondContact CA-OG1 3.18Å; G132-T136 PolarHBondContact O-OG1 2.96Å; T136-L138 PolarHBondContact O-N 3.36Å; T136-P139 WeakPolarHBondContact O-CD 3.27Å; T136-F140 HydrophobicContact CG2-CZ 4.41Å; T136-F140 WeakPolarHBondContact O-CB 3.37Å; T136-F140 WeakPolarHBondContact O-CD2 3.32Å; T136-F140 WeakPolarHBondContact O-CG 3.39Å; T136-F140 PolarHBondContact O-N 3.38Å; T136-F140 VanDerWaalsContact O-N 3.09Å
137V96.8Very high96Very high0 Ų042.2 Ų42.20%021%0.205CC..Hα-helixtrans-54-50177.6178.90000112Y17 L47 Q50 V102 T135 F140 I141Y17-V137 HydrophobicContact CE1-CG2 4.34Å; Y17-V137 WeakPolarHBondContact OH-CA 3.44Å; L47-V137 HydrophobicContact CD2-CG2 4.31Å; Q50-V137 HydrophobicContact CG-CG1 3.85Å; V102-V137 HydrophobicContact CG2-CB 4.07Å; T135-V137 PolarHBondContact O-N 2.87Å; T135-V137 VanDerWaalsContact O-N 3.16Å; V137-F140 PolarHBondContact O-N 2.94Å; V137-I141 PolarHBondContact O-N 2.88Å
138L96.6Very high95.8Very high50 Ų5038.9 Ų38.926%0.26219%0.191SC..Hα-helixtrans-69.4-47.5-174.6-176.364.6000113A99 V102 T135 T136 F140 I141 I142A99-L138 HydrophobicContact CB-CD1 4.06Å; V102-L138 HydrophobicContact CB-CB 4.34Å; V102-L138 HydrophobicContact CG1-CB 4.16Å; V102-L138 HydrophobicContact CG1-CD2 4.16Å; V102-L138 HydrophobicContact CG2-CB 3.95Å; T135-L138 PolarHBondContact O-N 3.38Å; T136-L138 PolarHBondContact O-N 3.36Å; L138-F140 VanDerWaalsContact C-N 3.35Å; L138-F140 PolarHBondContact O-N 3.44Å; L138-I141 HydrophobicContact CD1-CG2 4.26Å; L138-I141 WeakPolarHBondContact O-CG2 3.14Å; L138-I141 PolarHBondContact O-N 3.22Å; L138-I142 HydrophobicContact CD1-CD1 3.86Å; L138-I142 HydrophobicContact CD1-CG1 4.19Å; L138-I142 HydrophobicContact CG-CD1 3.8Å; L138-I142 WeakPolarHBondContact O-CB 3.49Å; L138-I142 VanDerWaalsContact O-CG1 3.24Å; L138-I142 WeakPolarHBondContact O-CG1 3.5Å; L138-I142 PolarHBondContact O-N 2.98Å
139P97.3Very high95.7Very high62 Ų6237.2 Ų37.240%0.40319%0.188SC..Hα-helixtrans-56.8-44.4172.3-27.135.5000113.3T135 T136 I142 I143T135-P139 WeakPolarHBondContact O-CD 3.34Å; T136-P139 WeakPolarHBondContact O-CD 3.27Å; P139-I142 PolarHBondContact O-N 3.31Å; P139-I143 WeakPolarHBondContact O-CB 3.48Å; P139-I143 WeakPolarHBondContact O-CD1 3.47Å; P139-I143 WeakPolarHBondContact O-CG1 3.45Å; P139-I143 PolarHBondContact O-N 2.92Å
140F97.4Very high95.5Very high44 Ų4437.1 Ų37.119%0.19319%0.188CC..Hα-helixtrans-64.5-43-178.6-67.9-13.7000112.4I13 S16 Y17 F54 T136 V137 L138 I143 E144I13-F140 HydrophobicContact CD1-CB 4.22Å; I13-F140 HydrophobicContact CD1-CD1 4.32Å; I13-F140 HydrophobicContact CD1-CG 4.31Å; I13-F140 HydrophobicContact CG1-CB 4.45Å; I13-F140 HydrophobicContact CG1-CD1 4.08Å; I13-F140 HydrophobicContact CG1-CD2 4.43Å; I13-F140 HydrophobicContact CG1-CE1 4.43Å; I13-F140 HydrophobicContact CG1-CG 4.08Å; I13-F140 HydrophobicContact CG2-CB 3.99Å; I13-F140 HydrophobicContact CG2-CD2 3.73Å; I13-F140 HydrophobicContact CG2-CE2 4.38Å; I13-F140 HydrophobicContact CG2-CG 3.93Å; S16-F140 VanDerWaalsContact OG-CE2 3.24Å; S16-F140 WeakPolarHBondContact OG-CE2 3.25Å; Y17-F140 AromaticContact CE2-CD2 3.93Å; Y17-F140 HydrophobicContact CE2-CD2 3.93Å; Y17-F140 AromaticContact CZ-CD2 3.81Å; F54-F140 HydrophobicContact CE2-CB 4.45Å; F54-F140 HydrophobicContact CZ-CB 4.32Å; T136-F140 HydrophobicContact CG2-CZ 4.41Å; T136-F140 WeakPolarHBondContact O-CB 3.37Å; T136-F140 WeakPolarHBondContact O-CD2 3.32Å; T136-F140 WeakPolarHBondContact O-CG 3.39Å; T136-F140 PolarHBondContact O-N 3.38Å; T136-F140 VanDerWaalsContact O-N 3.09Å; V137-F140 PolarHBondContact O-N 2.94Å; L138-F140 VanDerWaalsContact C-N 3.35Å; L138-F140 PolarHBondContact O-N 3.44Å; F140-I143 WeakPolarHBondContact O-CB 3.34Å; F140-I143 PolarHBondContact O-N 3.03Å; F140-E144 PolarHBondContact O-N 3.2Å
141I96.4Very high95.3Very high0 Ų040.6 Ų40.60%021%0.212CC..Hα-helixtrans-71.4-33.4179.8-153.557.5000112.1F53 F54 M90 A94 F95 V137 L138 E144 M145F53-I141 HydrophobicContact CD1-CD1 3.8Å; F53-I141 HydrophobicContact CE1-CD1 3.44Å; F53-I141 VanDerWaalsContact CE1-CD1 3.44Å; F53-I141 HydrophobicContact CZ-CD1 4.22Å; F54-I141 HydrophobicContact CE2-CD1 4.28Å; F54-I141 HydrophobicContact CZ-CD1 4.43Å; M90-I141 HydrophobicContact CE-CD1 3.84Å; M90-I141 HydrophobicContact CE-CG1 3.74Å; M90-I141 HydrophobicContact SD-CD1 3.35Å; M90-I141 WeakPolarHBondContact SD-CD1 3.49Å; M90-I141 HydrophobicContact SD-CG1 3.71Å; A94-I141 HydrophobicContact CB-CD1 3.88Å; A94-I141 HydrophobicContact CB-CG1 4.48Å; F95-I141 HydrophobicContact CB-CG1 4.34Å; F95-I141 HydrophobicContact CD2-CG1 4.3Å; F95-I141 HydrophobicContact CD2-CG2 3.85Å; F95-I141 HydrophobicContact CE2-CG2 4.31Å; V137-I141 PolarHBondContact O-N 2.88Å; L138-I141 HydrophobicContact CD1-CG2 4.26Å; L138-I141 WeakPolarHBondContact O-CG2 3.14Å; L138-I141 PolarHBondContact O-N 3.22Å; I141-E144 PolarHBondContact O-N 2.91Å; I141-M145 PolarHBondContact O-N 3.3Å
142I96.1Very high95.2Very high57 Ų5738.5 Ų38.529%0.29220%0.201SC..Hα-helixtrans-66.5-41.8172.7-70.3170.1000110.9L138 P139 E144 M145 R146 L217L138-I142 HydrophobicContact CD1-CD1 3.86Å; L138-I142 HydrophobicContact CD1-CG1 4.19Å; L138-I142 HydrophobicContact CG-CD1 3.8Å; L138-I142 WeakPolarHBondContact O-CB 3.49Å; L138-I142 VanDerWaalsContact O-CG1 3.24Å; L138-I142 WeakPolarHBondContact O-CG1 3.5Å; L138-I142 PolarHBondContact O-N 2.98Å; P139-I142 PolarHBondContact O-N 3.31Å; I142-E144 VanDerWaalsContact C-N 3.33Å; I142-E144 PolarHBondContact O-N 2.9Å; I142-M145 PolarHBondContact O-N 3.02Å; I142-R146 HydrophobicContact CG2-CG 4.43Å; I142-R146 WeakPolarHBondContact O-CB 3.47Å; I142-R146 WeakPolarHBondContact O-CG 3.35Å; I142-R146 PolarHBondContact O-N 3.3Å; I142-L217 HydrophobicContact CG1-CD2 4.46Å
143I95Very high95.1Very high63 Ų6339.8 Ų39.832%0.32321%0.208SC..Hα-helixtrans-58.4-47174.9-77167.2000110.3L9 I13 P139 F140 M145 R146 T147L9-I143 HydrophobicContact CD1-CG2 4.34Å; L9-I143 HydrophobicContact CD2-CG2 3.17Å; L9-I143 HydrophobicContact CG-CG2 3.87Å; I13-I143 HydrophobicContact CD1-CG2 4.36Å; P139-I143 WeakPolarHBondContact O-CB 3.48Å; P139-I143 WeakPolarHBondContact O-CD1 3.47Å; P139-I143 WeakPolarHBondContact O-CG1 3.45Å; P139-I143 PolarHBondContact O-N 2.92Å; F140-I143 WeakPolarHBondContact O-CB 3.34Å; F140-I143 PolarHBondContact O-N 3.03Å; I143-M145 PolarHBondContact O-N 3.19Å; I143-R146 WeakPolarHBondContact O-CB 3.33Å; I143-R146 PolarHBondContact O-N 3.03Å; I143-T147 WeakPolarHBondContact O-CG2 3.4Å; I143-T147 PolarHBondContact O-N 2.95Å; I143-T147 PolarHBondContact O-OG1 2.92Å
144E95.3Very high95Very high2 Ų249.1 Ų49.11%0.00924%0.243CC..Hα-helixtrans-58.3-49.8176176.161-163.600111.1R10 F53 F54 F140 I141 I142 R146 T147 T148 H150R10-E144 WeakPolarHBondContact CG-OE2 3.43Å; R10-E144 IonicContact CZ-OE1 3.99Å; R10-E144 IonicContact CZ-OE2 3.71Å; R10-E144 IonicContact NE-OE1 3.74Å; R10-E144 PolarHBondContact NE-OE1 3.5Å; R10-E144 IonicContact NE-OE2 3.87Å; R10-E144 PolarHBondContact NE-OE2 3.47Å; R10-E144 IonicContact NH2-OE1 2.86Å; R10-E144 PolarHBondContact NH2-OE1 3.42Å; R10-E144 IonicContact NH2-OE2 3.82Å; F53-E144 HydrophobicContact CE1-CB 4.45Å; F53-E144 HydrophobicContact CE1-CG 3.8Å; F53-E144 HydrophobicContact CZ-CG 3.8Å; F54-E144 HydrophobicContact CE1-CB 3.98Å; F54-E144 HydrophobicContact CE1-CG 4.38Å; F54-E144 HydrophobicContact CZ-CB 3.95Å; F140-E144 PolarHBondContact O-N 3.2Å; I141-E144 PolarHBondContact O-N 2.91Å; I142-E144 VanDerWaalsContact C-N 3.33Å; I142-E144 PolarHBondContact O-N 2.9Å; E144-R146 PolarHBondContact O-N 3.37Å; E144-T147 CarbonylContact O-C 3.57Å; E144-T147 PolarHBondContact O-N 3.43Å; E144-T147 PolarHBondContact O-OG1 3.29Å; E144-T148 PolarHBondContact O-N 3.03Å; E144-H150 IonicContact OE1-CE1 3.09Å; E144-H150 IonicContact OE1-NE2 2.65Å
145M94.3Very high94.9Very high0 Ų054.7 Ų54.70%026%0.264CS..Hα-helixtrans-58.1-32.5178.1-165.9-175.6-68.200113.1M90 F95 I141 I142 I143 T148 L217 N218 I221 W222M90-M145 HydrophobicContact CE-CB 3.73Å; M90-M145 HydrophobicContact CE-CE 3.71Å; M90-M145 HydrophobicContact CE-CG 4.25Å; F95-M145 HydrophobicContact CB-CE 4.48Å; F95-M145 HydrophobicContact CD2-CE 3.23Å; F95-M145 HydrophobicContact CE2-CE 3.43Å; F95-M145 VanDerWaalsContact CE2-CE 3.43Å; F95-M145 HydrophobicContact CG-CE 3.84Å; F95-M145 HydrophobicContact CZ-CE 4.21Å; I141-M145 PolarHBondContact O-N 3.3Å; I142-M145 PolarHBondContact O-N 3.02Å; I143-M145 PolarHBondContact O-N 3.19Å; M145-T148 VanDerWaalsContact O-O 3.08Å; M145-L217 HydrophobicContact SD-CB 4.09Å; M145-L217 HydrophobicContact SD-CD2 3.86Å; M145-L217 HydrophobicContact SD-CG 3.75Å; M145-N218 HydrophobicContact CG-CB 4.08Å; M145-N218 HydrophobicContact SD-CB 3.8Å; M145-I221 HydrophobicContact CB-CD1 4.42Å; M145-I221 HydrophobicContact CG-CD1 3.93Å; M145-I221 HydrophobicContact SD-CD1 3.88Å; M145-W222 PolarHBondContact O-NE1 2.88Å
146R93Very high94.8Very high151 Ų15156.2 Ų56.257%0.5728%0.277SS*.Hα-helixtrans-73.3-30.7174.2-77.9-69.4-1551677.2113.3I142 I143 E144 I221 W222I142-R146 HydrophobicContact CG2-CG 4.43Å; I142-R146 WeakPolarHBondContact O-CB 3.47Å; I142-R146 WeakPolarHBondContact O-CG 3.35Å; I142-R146 PolarHBondContact O-N 3.3Å; I143-R146 WeakPolarHBondContact O-CB 3.33Å; I143-R146 PolarHBondContact O-N 3.03Å; E144-R146 PolarHBondContact O-N 3.37Å; R146-I221 HydrophobicContact CG-CD1 4.11Å; R146-W222 WeakPolarHBondContact O-CZ2 3.39Å
147T92Very high94.8Very high49 Ų4963.2 Ų63.230%0.30130%0.299SS..Hα-helixtrans-93.3-16.7-177.262.50000113.4L9 I143 E144L9-T147 HydrophobicContact CD2-CG2 4.31Å; I143-T147 WeakPolarHBondContact O-CG2 3.4Å; I143-T147 PolarHBondContact O-N 2.95Å; I143-T147 PolarHBondContact O-OG1 2.92Å; E144-T147 CarbonylContact O-C 3.57Å; E144-T147 PolarHBondContact O-N 3.43Å; E144-T147 PolarHBondContact O-OG1 3.29Å
148T91.8Very high94.8Very high22 Ų2263.2 Ų63.214%0.13530%0.299CS..SBendtrans-144.3133.3178.7-74.70000112.2R10 E144 M145 H150 W222R10-T148 PolarHBondContact NH2-OG1 3.44Å; E144-T148 PolarHBondContact O-N 3.03Å; M145-T148 VanDerWaalsContact O-O 3.08Å; T148-H150 PolarHBondContact O-CD2 3.15Å; T148-H150 PolarHBondContact O-N 2.87Å; T148-W222 PolarHBondContact O-NE1 3.29Å
149H92.3Very high94.9Very high91 Ų9163 Ų6342%0.42130%0.298SS..  trans-73.9123.7172.7-178.8-114.5000109.5W222H149-W222 HydrophobicContact CB-CD2 3.66Å; H149-W222 HydrophobicContact CB-CE3 4.07Å; H149-W222 HydrophobicContact CB-CG 3.92Å; H149-W222 HydrophobicContact CB-CZ2 4.28Å; H149-W222 VanDerWaalsContact CD2-CB 3.49Å; H149-W222 WeakPolarHBondContact CD2-CB 3.47Å; H149-W222 AromaticContact CD2-CD1 3.52Å; H149-W222 AromaticContact CD2-CG 3.38Å; H149-W222 AromaticContact CG-CG 3.97Å; H149-W222 VanDerWaalsContact N-CZ2 3.28Å
150H93.5Very high94.9Very high0 Ų062.7 Ų62.70%030%0.3CS..  trans-107.5133.2176.9-65.3-74000111D87 M90 E144 T148 Y152 N218D87-H150 IonicContact OD1-CE1 2.83Å; D87-H150 IonicContact OD1-CG 2.83Å; D87-H150 IonicContact OD1-ND1 3.51Å; D87-H150 PolarHBondContact OD1-ND1 2.95Å; M90-H150 HydrophobicContact CG-CB 4.15Å; E144-H150 IonicContact OE1-CE1 3.09Å; E144-H150 IonicContact OE1-NE2 2.65Å; T148-H150 PolarHBondContact O-CD2 3.15Å; T148-H150 PolarHBondContact O-N 2.87Å; H150-Y152 PolarHBondContact O-N 3.12Å; H150-N218 PolarHBondContact N-OD1 3.2Å; H150-N218 PolarHBondContact O-ND2 2.92Å
151S92.6Very high94.9Very high72 Ų7261.8 Ų61.850%0.50330%0.301SS..  trans-83.7110.6176.7-52.40000110.4D87D87-S151 PolarHBondContact OD2-N 3.03Å; D87-S151 PolarHBondContact OD2-OG 3.37Å
152Y94.3Very high95Very high39 Ų3961.8 Ų61.815%0.15330%0.301CS..PPolyproline II helixtrans-73.4142.3175.1-85.3-115.2000111A91 H150 Y211 G214 E215 N218A91-Y152 HydrophobicContact CB-CD1 3.54Å; A91-Y152 HydrophobicContact CB-CD2 4.15Å; A91-Y152 HydrophobicContact CB-CE1 3.58Å; A91-Y152 HydrophobicContact CB-CE2 4.19Å; A91-Y152 HydrophobicContact CB-CG 3.83Å; H150-Y152 PolarHBondContact O-N 3.12Å; Y152-Y211 HydrophobicContact CD1-CE2 4.06Å; Y152-Y211 HydrophobicContact CE1-CE2 4.24Å; Y152-G214 PolarHBondContact OH-O 2.87Å; Y152-E215 HydrophobicContact CD1-CB 3.64Å; Y152-E215 HydrophobicContact CD1-CG 3.84Å; Y152-E215 HydrophobicContact CE1-CB 3.8Å; Y152-E215 HydrophobicContact CE1-CG 4.48Å; Y152-E215 HydrophobicContact CG-CB 4.26Å; Y152-E215 HydrophobicContact CG-CG 4.06Å; Y152-N218 HydrophobicContact CD2-CB 4.23Å; Y152-N218 HydrophobicContact CE2-CB 3.64Å
153P94Very high95.1Very high33 Ų3361 Ų6121%0.21430%0.301CS..PPolyproline II helixtrans-66.2171169.831.2-34.8000110.3V92 R155 Y211V92-P153 HydrophobicContact CG2-CG 4.11Å; P153-R155 PolarHBondContact O-N 3.26Å; P153-Y211 PolarHBondContact O-OH 3.33Å
154R94.8Very high95.2Very high202 Ų20264.2 Ų64.276%0.76232%0.318SS*.PPolyproline II helixtrans-51.4128.2169.6-78.3178.9152.5166.1-6.2109.9S156 W157 G158R154-S156 PolarHBondContact O-N 3.25Å; R154-W157 WeakPolarHBondContact O-CA 3.37Å; R154-W157 WeakPolarHBondContact O-CB 3.38Å; R154-W157 PolarHBondContact O-N 2.84Å; R154-G158 PolarHBondContact O-N 2.83Å
155R95.4Very high95.4Very high125 Ų12566.5 Ų66.547%0.47233%0.328SS..Hα-helixtrans-45.5-43.8-175.5-177.1178.5-70.7178.8-2.3114P153 W157 G158 L159 Y211 E215P153-R155 PolarHBondContact O-N 3.26Å; R155-W157 PolarHBondContact O-N 2.83Å; R155-G158 PolarHBondContact O-N 2.72Å; R155-L159 HydrophobicContact CG-CD1 3.87Å; R155-L159 HydrophobicContact CG-CG 4.3Å; R155-L159 WeakPolarHBondContact O-CB 3.41Å; R155-L159 VanDerWaalsContact O-CG 3.29Å; R155-L159 WeakPolarHBondContact O-CG 3.28Å; R155-L159 PolarHBondContact O-N 3.38Å; R155-Y211 HydrophobicContact CG-CE1 4.18Å; R155-E215 IonicContact CZ-OE2 2.73Å; R155-E215 IonicContact NE-OE1 2.67Å; R155-E215 IonicContact NE-OE2 3.9Å; R155-E215 PolarHBondContact NE-OE2 2.86Å; R155-E215 IonicContact NH2-OE2 2.72Å; R155-E215 PolarHBondContact NH2-OE2 3.25Å
156S95.9Very high95.5Very high81 Ų8167 Ų6757%0.56633%0.332SS*.Hα-helixtrans-63-41178.552.40000113.3R154 A160R154-S156 PolarHBondContact O-N 3.25Å; S156-A160 VanDerWaalsContact O-CB 3.26Å; S156-A160 WeakPolarHBondContact O-CB 3.41Å; S156-A160 PolarHBondContact O-N 2.67Å
157W96.9Very high95.8Very high184 Ų18463 Ų6370%0.69733%0.325SS*.Hα-helixtrans-71.8-39176.5-76.7101.6000112.1R154 R155 A160 A161R154-W157 WeakPolarHBondContact O-CA 3.37Å; R154-W157 WeakPolarHBondContact O-CB 3.38Å; R154-W157 PolarHBondContact O-N 2.84Å; R155-W157 PolarHBondContact O-N 2.83Å; W157-A160 PolarHBondContact O-N 3.24Å; W157-A161 WeakPolarHBondContact O-CB 3.25Å; W157-A161 PolarHBondContact O-N 3.18Å
158G96.9Very high96.1Very high0 Ų062.4 Ų62.40%033%0.329CS..Hα-helixtrans-62.3-49.1173.900000112R154 R155 A160 A161 V162R154-G158 PolarHBondContact O-N 2.83Å; R155-G158 PolarHBondContact O-N 2.72Å; G158-A160 PolarHBondContact O-N 3Å; G158-A161 PolarHBondContact O-N 3.33Å; G158-V162 WeakPolarHBondContact O-CG2 3.49Å; G158-V162 PolarHBondContact O-N 3.4Å
159L97.9Very high96.4Very high47 Ų4762.6 Ų62.625%0.24633%0.327CS..Hα-helixtrans-60.3-43.9174.5-74173.1000112.2R155 A161 V162 C163 C208 Y211 V212R155-L159 HydrophobicContact CG-CD1 3.87Å; R155-L159 HydrophobicContact CG-CG 4.3Å; R155-L159 WeakPolarHBondContact O-CB 3.41Å; R155-L159 VanDerWaalsContact O-CG 3.29Å; R155-L159 WeakPolarHBondContact O-CG 3.28Å; R155-L159 PolarHBondContact O-N 3.38Å; L159-A161 VanDerWaalsContact C-N 3.29Å; L159-A161 PolarHBondContact O-N 2.98Å; L159-V162 PolarHBondContact O-N 2.95Å; L159-C163 VanDerWaalsContact O-CB 3.3Å; L159-C163 WeakPolarHBondContact O-CB 3.31Å; L159-C163 PolarHBondContact O-N 3.4Å; L159-C163 PolarHBondContact O-SG 2.95Å; L159-C208 HydrophobicContact CD2-CB 3.85Å; L159-Y211 HydrophobicContact CD2-CD1 3.64Å; L159-Y211 HydrophobicContact CD2-CE1 4.42Å; L159-Y211 HydrophobicContact CD2-CG 4.19Å; L159-Y211 HydrophobicContact CG-CD1 3.89Å; L159-Y211 HydrophobicContact CG-CE1 4.17Å; L159-V212 HydrophobicContact CD2-CG2 4.23Å
160A97.9Very high96.7Very high54 Ų5459.8 Ų59.845%0.44632%0.315SS..Hα-helixtrans-59.3-41.8176.600000111.9S156 W157 G158 L164S156-A160 VanDerWaalsContact O-CB 3.26Å; S156-A160 WeakPolarHBondContact O-CB 3.41Å; S156-A160 PolarHBondContact O-N 2.67Å; W157-A160 PolarHBondContact O-N 3.24Å; G158-A160 PolarHBondContact O-N 3Å; A160-L164 VanDerWaalsContact O-CB 3.31Å; A160-L164 WeakPolarHBondContact O-CB 3.4Å; A160-L164 PolarHBondContact O-N 2.98Å
161A97.7Very high96.9Very high26 Ų2665.1 Ų65.122%0.21534%0.343CS..Hα-helixtrans-70-40.9178.900000112.6W88 V92 W157 G158 L159 L164 F165W88-A161 HydrophobicContact CZ2-CB 4.41Å; V92-A161 HydrophobicContact CG1-CB 3.41Å; V92-A161 VanDerWaalsContact CG1-CB 3.41Å; V92-A161 HydrophobicContact CG2-CB 4.4Å; W157-A161 WeakPolarHBondContact O-CB 3.25Å; W157-A161 PolarHBondContact O-N 3.18Å; G158-A161 PolarHBondContact O-N 3.33Å; L159-A161 VanDerWaalsContact C-N 3.29Å; L159-A161 PolarHBondContact O-N 2.98Å; A161-L164 PolarHBondContact O-N 3.31Å; A161-F165 PolarHBondContact O-N 3.49Å
162V97.8Very high97.1Very high0 Ų065.2 Ų65.20%033%0.332CS..Hα-helixtrans-64.1-43.2174.4172.40000111.3V92 P96 G158 L159 F165 G166 I207 Y211V92-V162 HydrophobicContact CG1-CG2 4.12Å; V92-V162 WeakPolarHBondContact O-CG2 3.22Å; P96-V162 HydrophobicContact CB-CG2 4.35Å; P96-V162 HydrophobicContact CG-CG2 3.99Å; G158-V162 WeakPolarHBondContact O-CG2 3.49Å; G158-V162 PolarHBondContact O-N 3.4Å; L159-V162 PolarHBondContact O-N 2.95Å; V162-F165 PolarHBondContact O-N 3.12Å; V162-G166 PolarHBondContact O-N 3.24Å; V162-I207 HydrophobicContact CG1-CB 4.25Å; V162-I207 HydrophobicContact CG1-CD1 3.93Å; V162-I207 HydrophobicContact CG1-CG1 3.63Å; V162-I207 HydrophobicContact CG1-CG2 3.92Å; V162-Y211 HydrophobicContact CG2-CD2 3.71Å; V162-Y211 HydrophobicContact CG2-CG 4.17Å
163C97.8Very high97.2Very high41 Ų4163.5 Ų63.528%0.27733%0.325SS..Hα-helixtrans-59.8-45.9173-77.70000111.6L159 F165 G166 V167 C208L159-C163 VanDerWaalsContact O-CB 3.3Å; L159-C163 WeakPolarHBondContact O-CB 3.31Å; L159-C163 PolarHBondContact O-N 3.4Å; L159-C163 PolarHBondContact O-SG 2.95Å; C163-F165 VanDerWaalsContact C-N 3.32Å; C163-F165 PolarHBondContact O-N 2.86Å; C163-G166 PolarHBondContact O-N 3.36Å; C163-V167 WeakPolarHBondContact O-CB 3.37Å; C163-V167 WeakPolarHBondContact O-CG2 3.38Å; C163-V167 PolarHBondContact O-N 3.06Å; C163-C208 PolarHBondContact SG-SG 3.38Å
164L98.1Very high97.4Very high130 Ų13064 Ų6468%0.68133%0.329SS*.Hα-helixtrans-60.4-43.6179-179.463.2000111.2A160 A161 G168A160-L164 VanDerWaalsContact O-CB 3.31Å; A160-L164 WeakPolarHBondContact O-CB 3.4Å; A160-L164 PolarHBondContact O-N 2.98Å; A161-L164 PolarHBondContact O-N 3.31Å; L164-G168 PolarHBondContact O-N 3.49Å
165F98.1Very high97.5Very high50 Ų5060.9 Ų60.922%0.21932%0.318CS..Hα-helixtrans-61-49.1173.9177.6-92000111.7L42 I45 I49 L93 V97 A161 V162 C163 V167 G168 Y169 I207L42-F165 HydrophobicContact CD1-CE1 4.12Å; L42-F165 HydrophobicContact CD1-CZ 4.18Å; I45-F165 HydrophobicContact CG2-CE2 4.49Å; I45-F165 HydrophobicContact CG2-CZ 4.17Å; I49-F165 HydrophobicContact CD1-CE2 4.07Å; I49-F165 HydrophobicContact CD1-CZ 3.96Å; L93-F165 HydrophobicContact CD2-CD2 3.81Å; L93-F165 HydrophobicContact CD2-CE2 4.23Å; L93-F165 HydrophobicContact CD2-CG 4.17Å; V97-F165 HydrophobicContact CB-CE1 4.43Å; V97-F165 HydrophobicContact CG1-CE1 4.06Å; V97-F165 HydrophobicContact CG1-CZ 4.32Å; V97-F165 HydrophobicContact CG2-CD1 3.81Å; V97-F165 HydrophobicContact CG2-CE1 3.42Å; V97-F165 VanDerWaalsContact CG2-CE1 3.42Å; V97-F165 HydrophobicContact CG2-CZ 3.97Å; A161-F165 PolarHBondContact O-N 3.49Å; V162-F165 PolarHBondContact O-N 3.12Å; C163-F165 VanDerWaalsContact C-N 3.32Å; C163-F165 PolarHBondContact O-N 2.86Å; F165-V167 PolarHBondContact O-N 3.31Å; F165-G168 PolarHBondContact O-N 2.91Å; F165-Y169 PolarHBondContact O-N 3.24Å; F165-I207 HydrophobicContact CD1-CD1 4.38Å
166G97.7Very high97.5Very high10 Ų1055 Ų5510%0.10330%0.296CS..Hα-helixtrans-59.9-47.6179.600000112.8V162 C163 G168 Y169 I170V162-G166 PolarHBondContact O-N 3.24Å; C163-G166 PolarHBondContact O-N 3.36Å; G166-G168 VanDerWaalsContact C-N 3.35Å; G166-G168 PolarHBondContact O-N 2.83Å; G166-Y169 PolarHBondContact O-N 3.5Å; G166-I170 WeakPolarHBondContact O-CG1 3.42Å; G166-I170 PolarHBondContact O-N 3.44Å
167V97.8Very high97.5Very high67 Ų6753.5 Ų53.541%0.40628%0.28SS..Hα-helixtrans-62.5-42.8175.3172.10000110.8C163 F165 Y169 I170 L171C163-V167 WeakPolarHBondContact O-CB 3.37Å; C163-V167 WeakPolarHBondContact O-CG2 3.38Å; C163-V167 PolarHBondContact O-N 3.06Å; F165-V167 PolarHBondContact O-N 3.31Å; V167-Y169 VanDerWaalsContact C-N 3.3Å; V167-Y169 PolarHBondContact O-N 3.46Å; V167-I170 PolarHBondContact O-N 2.72Å; V167-L171 HydrophobicContact CG1-CD1 4.06Å; V167-L171 HydrophobicContact CG1-CG 4.28Å; V167-L171 VanDerWaalsContact O-CG 3.31Å; V167-L171 WeakPolarHBondContact O-CG 3.1Å; V167-L171 PolarHBondContact O-N 3.32Å
168G98.3Very high97.4Very high37 Ų3751.9 Ų51.938%0.38128%0.28SS..Hα-helixtrans-56.9-43.4175.300000112.6L164 F165 G166 L171 W172L164-G168 PolarHBondContact O-N 3.49Å; F165-G168 PolarHBondContact O-N 2.91Å; G166-G168 VanDerWaalsContact C-N 3.35Å; G166-G168 PolarHBondContact O-N 2.83Å; G168-L171 PolarHBondContact O-N 2.93Å; G168-W172 WeakPolarHBondContact O-CB 3.42Å; G168-W172 PolarHBondContact O-N 2.9Å
169Y98.3Very high97.4Very high26 Ų2655.2 Ų55.210%0.10230%0.3CS..Hα-helixtrans-70.4-35.8177.1-177-107.2000113.4K40 L42 I45 F165 G166 V167 W172 T173 Y185K40-Y169 PolarHBondContact O-OH 2.94Å; L42-Y169 HydrophobicContact CB-CD1 4.39Å; L42-Y169 HydrophobicContact CB-CE1 3.71Å; L42-Y169 HydrophobicContact CB-CE2 4.15Å; L42-Y169 HydrophobicContact CD1-CD1 4.05Å; L42-Y169 HydrophobicContact CD1-CD2 4.07Å; L42-Y169 HydrophobicContact CD1-CE1 4.21Å; L42-Y169 HydrophobicContact CD1-CE2 4.25Å; L42-Y169 HydrophobicContact CD1-CG 3.99Å; L42-Y169 HydrophobicContact CD2-CD1 4.24Å; L42-Y169 HydrophobicContact CD2-CE1 4.15Å; L42-Y169 HydrophobicContact CG-CD1 4.46Å; L42-Y169 HydrophobicContact CG-CE1 4.24Å; L42-Y169 PolarHBondContact N-OH 2.88Å; L42-Y169 VanDerWaalsContact N-OH 3.09Å; I45-Y169 HydrophobicContact CD1-CD2 3.71Å; I45-Y169 HydrophobicContact CD1-CE2 3.67Å; F165-Y169 PolarHBondContact O-N 3.24Å; G166-Y169 PolarHBondContact O-N 3.5Å; V167-Y169 VanDerWaalsContact C-N 3.3Å; V167-Y169 PolarHBondContact O-N 3.46Å; Y169-W172 AromaticContact CE2-CD1 3.96Å; Y169-W172 WeakPolarHBondContact O-CB 3.34Å; Y169-W172 PolarHBondContact O-N 3.43Å; Y169-T173 PolarHBondContact O-N 3.39Å; Y169-T173 PolarHBondContact O-OG1 3.32Å; Y169-Y185 HydrophobicContact CE1-CE2 4.08Å; Y169-Y185 VanDerWaalsContact OH-CE2 3.27Å; Y169-Y185 WeakPolarHBondContact OH-CE2 3.22Å; Y169-Y185 PolarHBondContact OH-OH 3.34Å
170I97.9Very high97.2Very high32 Ų3255.6 Ų55.616%0.16430%0.304CS..Hα-helixtrans-61.8-48172.3-70.1160.4000110.1G166 V167 W172 T173 C174 F200 T204G166-I170 WeakPolarHBondContact O-CG1 3.42Å; G166-I170 PolarHBondContact O-N 3.44Å; V167-I170 PolarHBondContact O-N 2.72Å; I170-W172 VanDerWaalsContact C-N 3.29Å; I170-W172 PolarHBondContact O-N 3.23Å; I170-T173 WeakPolarHBondContact O-CB 3.44Å; I170-T173 PolarHBondContact O-N 2.87Å; I170-T173 VanDerWaalsContact O-N 3.13Å; I170-C174 PolarHBondContact O-N 3.31Å; I170-C174 PolarHBondContact O-SG 2.92Å; I170-C174 VanDerWaalsContact O-SG 3.39Å; I170-F200 HydrophobicContact CD1-CB 3.98Å; I170-F200 HydrophobicContact CD1-CD1 4.35Å; I170-F200 HydrophobicContact CD1-CG 4.36Å; I170-F200 HydrophobicContact CG1-CB 4.46Å; I170-F200 HydrophobicContact CG1-CD1 3.94Å; I170-F200 HydrophobicContact CG1-CE1 4.49Å; I170-F200 HydrophobicContact CG1-CG 4.3Å; I170-F200 HydrophobicContact CG2-CB 4.36Å; I170-F200 HydrophobicContact CG2-CD1 4.01Å; I170-F200 HydrophobicContact CG2-CD2 3.9Å; I170-F200 HydrophobicContact CG2-CE1 4.24Å; I170-F200 HydrophobicContact CG2-CE2 4.13Å; I170-F200 HydrophobicContact CG2-CG 3.85Å; I170-F200 HydrophobicContact CG2-CZ 4.29Å; I170-T204 WeakPolarHBondContact CD1-OG1 3.38Å
171L98.1Very high96.9Very high112 Ų11255.4 Ų55.459%0.58631%0.308SS*.Hα-helixtrans-59.2-41.7176.9-70174.6000111.4V167 G168 C174 W175V167-L171 HydrophobicContact CG1-CD1 4.06Å; V167-L171 HydrophobicContact CG1-CG 4.28Å; V167-L171 VanDerWaalsContact O-CG 3.31Å; V167-L171 WeakPolarHBondContact O-CG 3.1Å; V167-L171 PolarHBondContact O-N 3.32Å; G168-L171 PolarHBondContact O-N 2.93Å; L171-C174 PolarHBondContact O-N 3.38Å; L171-W175 WeakPolarHBondContact O-CB 3.24Å; L171-W175 PolarHBondContact O-N 2.85Å
172W97.9Very high96.6Very high73 Ų7358.6 Ų58.628%0.27733%0.325SS..Hα-helixtrans-60.8-44.6174.2174.8-126.6000112.4Y35 W39 G168 Y169 I170 C174 W175 V176Y35-W172 HydrophobicContact CE1-CH2 4.11Å; Y35-W172 HydrophobicContact CE1-CZ3 4.39Å; W39-W172 PolarHBondContact O-NE1 3.16Å; G168-W172 WeakPolarHBondContact O-CB 3.42Å; G168-W172 PolarHBondContact O-N 2.9Å; Y169-W172 AromaticContact CE2-CD1 3.96Å; Y169-W172 WeakPolarHBondContact O-CB 3.34Å; Y169-W172 PolarHBondContact O-N 3.43Å; I170-W172 VanDerWaalsContact C-N 3.29Å; I170-W172 PolarHBondContact O-N 3.23Å; W172-C174 PolarHBondContact O-N 3.5Å; W172-W175 HydrophobicContact CE3-CB 4.42Å; W172-W175 AromaticContact CE3-CD1 3.93Å; W172-W175 HydrophobicContact CE3-CG 4.48Å; W172-W175 AromaticContact CZ3-CD1 3.55Å; W172-W175 HydrophobicContact CZ3-CG 4.48Å; W172-W175 WeakPolarHBondContact O-CB 3.34Å; W172-W175 PolarHBondContact O-N 2.9Å; W172-V176 HydrophobicContact CD2-CG2 3.98Å; W172-V176 HydrophobicContact CE3-CG2 4.19Å; W172-V176 HydrophobicContact CH2-CG2 3.86Å; W172-V176 HydrophobicContact CZ2-CG2 3.64Å; W172-V176 HydrophobicContact CZ3-CG2 4.14Å; W172-V176 WeakPolarHBondContact O-CG2 3.29Å; W172-V176 PolarHBondContact O-N 3.46Å
173T96.4Very high96.5Very high3 Ų360 Ų602%0.01833%0.33CS..Hα-helixtrans-62.2-43.5177.2-60.50000111.7Y169 I170 W175 V176 H177 W183 V184 L188Y169-T173 PolarHBondContact O-N 3.39Å; Y169-T173 PolarHBondContact O-OG1 3.32Å; I170-T173 WeakPolarHBondContact O-CB 3.44Å; I170-T173 PolarHBondContact O-N 2.87Å; I170-T173 VanDerWaalsContact O-N 3.13Å; T173-W175 VanDerWaalsContact C-N 3.35Å; T173-V176 PolarHBondContact O-N 3.45Å; T173-H177 PolarHBondContact O-N 2.95Å; T173-H177 VanDerWaalsContact O-N 3.1Å; T173-W183 HydrophobicContact CG2-CE3 4.06Å; T173-W183 HydrophobicContact CG2-CZ3 4.22Å; T173-V184 HydrophobicContact CG2-CB 4.12Å; T173-V184 HydrophobicContact CG2-CG2 4.02Å; T173-L188 HydrophobicContact CG2-CD1 3.82Å
174C96.8Very high96.3Very high44 Ų4458.7 Ų58.730%0.29732%0.321SS..Hα-helixtrans-63.2-40.2174.8-69.10000112I170 L171 W172 H177 Q178I170-C174 PolarHBondContact O-N 3.31Å; I170-C174 PolarHBondContact O-SG 2.92Å; I170-C174 VanDerWaalsContact O-SG 3.39Å; L171-C174 PolarHBondContact O-N 3.38Å; W172-C174 PolarHBondContact O-N 3.5Å; C174-H177 PolarHBondContact O-N 3.42Å; C174-Q178 WeakPolarHBondContact O-CB 3.39Å; C174-Q178 PolarHBondContact O-N 2.85Å
175W97.6Very high96.1Very high136 Ų13654.4 Ų54.452%0.51530%0.296SS..Hα-helixtrans-63.7-45.5176.5179.5-95.1000112Y35 L171 W172 T173 H177 Q178 V179Y35-W175 AromaticContact CE1-CD1 3.95Å; Y35-W175 AromaticContact CE1-NE1 3.83Å; Y35-W175 AromaticContact CZ-NE1 3.84Å; Y35-W175 PolarHBondContact OH-NE1 2.87Å; L171-W175 WeakPolarHBondContact O-CB 3.24Å; L171-W175 PolarHBondContact O-N 2.85Å; W172-W175 HydrophobicContact CE3-CB 4.42Å; W172-W175 AromaticContact CE3-CD1 3.93Å; W172-W175 HydrophobicContact CE3-CG 4.48Å; W172-W175 AromaticContact CZ3-CD1 3.55Å; W172-W175 HydrophobicContact CZ3-CG 4.48Å; W172-W175 WeakPolarHBondContact O-CB 3.34Å; W172-W175 PolarHBondContact O-N 2.9Å; T173-W175 VanDerWaalsContact C-N 3.35Å; W175-H177 VanDerWaalsContact C-N 3.31Å; W175-H177 PolarHBondContact O-N 3.32Å; W175-Q178 WeakPolarHBondContact O-CB 3.36Å; W175-Q178 PolarHBondContact O-N 3.47Å; W175-Q178 VanDerWaalsContact O-N 3.12Å; W175-V179 HydrophobicContact CD2-CG2 4.44Å; W175-V179 HydrophobicContact CZ2-CG2 4.21Å; W175-V179 WeakPolarHBondContact O-CG2 3.48Å; W175-V179 PolarHBondContact O-N 2.98Å
176V96.1Very high96Very high3 Ų353.8 Ų53.82%0.01830%0.297CS..Hα-helixtrans-58.6-44175.7171.30000110.9Y35 K40 W172 T173 V179 T180 V184Y35-V176 HydrophobicContact CD1-CG2 4.46Å; K40-V176 HydrophobicContact CB-CG2 4.33Å; W172-V176 HydrophobicContact CD2-CG2 3.98Å; W172-V176 HydrophobicContact CE3-CG2 4.19Å; W172-V176 HydrophobicContact CH2-CG2 3.86Å; W172-V176 HydrophobicContact CZ2-CG2 3.64Å; W172-V176 HydrophobicContact CZ3-CG2 4.14Å; W172-V176 WeakPolarHBondContact O-CG2 3.29Å; W172-V176 PolarHBondContact O-N 3.46Å; T173-V176 PolarHBondContact O-N 3.45Å; V176-V179 PolarHBondContact O-N 3.43Å; V176-T180 HydrophobicContact CG1-CG2 4.42Å; V176-T180 WeakPolarHBondContact O-CB 3.28Å; V176-T180 WeakPolarHBondContact O-CG2 3.31Å; V176-T180 PolarHBondContact O-N 3.2Å; V176-T180 PolarHBondContact O-OG1 3.41Å; V176-V184 HydrophobicContact CB-CG2 4.22Å; V176-V184 HydrophobicContact CG1-CG2 3.94Å
177H95.2Very high95.9Very high48 Ų4853.9 Ų53.922%0.22230%0.295CS..Hα-helixtrans-62.2-43.4174.5171.5-91.5000111.8T173 C174 W175 V179 T180 G181 W183T173-H177 PolarHBondContact O-N 2.95Å; T173-H177 VanDerWaalsContact O-N 3.1Å; C174-H177 PolarHBondContact O-N 3.42Å; W175-H177 VanDerWaalsContact C-N 3.31Å; W175-H177 PolarHBondContact O-N 3.32Å; H177-V179 VanDerWaalsContact C-N 3.27Å; H177-V179 PolarHBondContact O-N 2.86Å; H177-T180 PolarHBondContact O-N 3.48Å; H177-G181 VanDerWaalsContact O-CA 3.27Å; H177-G181 WeakPolarHBondContact O-CA 3.2Å; H177-G181 PolarHBondContact O-N 3.33Å; H177-W183 HydrophobicContact CB-CD2 3.93Å; H177-W183 HydrophobicContact CB-CE3 3.73Å; H177-W183 HydrophobicContact CB-CH2 4.15Å; H177-W183 HydrophobicContact CB-CZ2 4.31Å; H177-W183 HydrophobicContact CB-CZ3 3.86Å; H177-W183 AromaticContact CD2-CD1 3.48Å; H177-W183 VanDerWaalsContact CD2-CD1 3.48Å; H177-W183 AromaticContact CD2-CD2 3.56Å; H177-W183 AromaticContact CD2-CE2 3.33Å; H177-W183 AromaticContact CD2-CG 3.67Å; H177-W183 AromaticContact CD2-CZ2 3.9Å; H177-W183 AromaticContact CD2-NE1 3.24Å; H177-W183 PolarHBondContact CD2-NE1 3.15Å; H177-W183 AromaticContact CE1-CE2 3.99Å; H177-W183 AromaticContact CE1-CZ2 3.9Å; H177-W183 AromaticContact CE1-NE1 3.98Å; H177-W183 AromaticContact CG-CD2 3.75Å; H177-W183 AromaticContact CG-CE2 3.56Å; H177-W183 AromaticContact CG-CZ2 3.72Å; H177-W183 AromaticContact CG-NE1 3.96Å; H177-W183 AromaticContact ND1-CE2 3.97Å; H177-W183 AromaticContact ND1-CZ2 3.72Å; H177-W183 AromaticContact NE2-CD1 3.81Å; H177-W183 AromaticContact NE2-CE2 3.6Å; H177-W183 AromaticContact NE2-CZ2 4Å; H177-W183 AromaticContact NE2-NE1 3.25Å; H177-W183 PolarHBondContact NE2-NE1 3.43Å
178Q95.6Very high95.8Very high150 Ų15050.8 Ų50.870%0.70128%0.277SS*.Hα-helixtrans-59.7-37.3178.3-174.463.621.100112.5C174 W175C174-Q178 WeakPolarHBondContact O-CB 3.39Å; C174-Q178 PolarHBondContact O-N 2.85Å; W175-Q178 WeakPolarHBondContact O-CB 3.36Å; W175-Q178 PolarHBondContact O-N 3.47Å; W175-Q178 VanDerWaalsContact O-N 3.12Å
179V95.8Very high95.6Very high70 Ų7054.2 Ų54.242%0.42428%0.283SS..Hα-helixtrans-80.5-36.5-179.2174.30000112.5Y35 W175 V176 H177Y35-V179 HydrophobicContact CD1-CB 4.06Å; Y35-V179 HydrophobicContact CD1-CG1 3.8Å; Y35-V179 HydrophobicContact CD2-CG1 4.1Å; Y35-V179 HydrophobicContact CE1-CB 4.04Å; Y35-V179 HydrophobicContact CE1-CG1 3.97Å; Y35-V179 HydrophobicContact CE1-CG2 4.04Å; Y35-V179 HydrophobicContact CE2-CG1 4.25Å; Y35-V179 HydrophobicContact CG-CG1 3.86Å; W175-V179 HydrophobicContact CD2-CG2 4.44Å; W175-V179 HydrophobicContact CZ2-CG2 4.21Å; W175-V179 WeakPolarHBondContact O-CG2 3.48Å; W175-V179 PolarHBondContact O-N 2.98Å; V176-V179 PolarHBondContact O-N 3.43Å; H177-V179 VanDerWaalsContact C-N 3.27Å; H177-V179 PolarHBondContact O-N 2.86Å
180T93.6Very high95.4Very high55 Ų5559.8 Ų59.834%0.33730%0.304SS..Hα-helixtrans-106-17.2-170.263.10000114.6Y35 V176 H177 V182Y35-T180 HydrophobicContact CD1-CG2 4.31Å; Y35-T180 HydrophobicContact CG-CG2 4.36Å; V176-T180 HydrophobicContact CG1-CG2 4.42Å; V176-T180 WeakPolarHBondContact O-CB 3.28Å; V176-T180 WeakPolarHBondContact O-CG2 3.31Å; V176-T180 PolarHBondContact O-N 3.2Å; V176-T180 PolarHBondContact O-OG1 3.41Å; H177-T180 PolarHBondContact O-N 3.48Å; T180-V182 PolarHBondContact O-N 3Å; T180-V182 PolarHBondContact OG1-N 3.24Å; T180-V182 PolarHBondContact OG1-O 3.47Å
181G93.2Very high95.3Very high51 Ų5160.4 Ų60.453%0.52631%0.307SS..SBendtrans71.96.2-169.600000114.5H177H177-G181 VanDerWaalsContact O-CA 3.27Å; H177-G181 WeakPolarHBondContact O-CA 3.2Å; H177-G181 PolarHBondContact O-N 3.33Å
182V91.4Very high95.2Very high93 Ų9359.4 Ų59.456%0.56431%0.305SS*.SBendtrans-125.8131-175.4-179.40000110.4T180T180-V182 PolarHBondContact O-N 3Å; T180-V182 PolarHBondContact OG1-N 3.24Å; T180-V182 PolarHBondContact OG1-O 3.47Å
183W94.6Very high95.1Very high29 Ų2960.2 Ų60.211%0.1132%0.32CS..  trans-71.6142.7173.6-71.9102.8000111.9T173 H177 Y185 L188 E189 F200T173-W183 HydrophobicContact CG2-CE3 4.06Å; T173-W183 HydrophobicContact CG2-CZ3 4.22Å; H177-W183 HydrophobicContact CB-CD2 3.93Å; H177-W183 HydrophobicContact CB-CE3 3.73Å; H177-W183 HydrophobicContact CB-CH2 4.15Å; H177-W183 HydrophobicContact CB-CZ2 4.31Å; H177-W183 HydrophobicContact CB-CZ3 3.86Å; H177-W183 AromaticContact CD2-CD1 3.48Å; H177-W183 VanDerWaalsContact CD2-CD1 3.48Å; H177-W183 AromaticContact CD2-CD2 3.56Å; H177-W183 AromaticContact CD2-CE2 3.33Å; H177-W183 AromaticContact CD2-CG 3.67Å; H177-W183 AromaticContact CD2-CZ2 3.9Å; H177-W183 AromaticContact CD2-NE1 3.24Å; H177-W183 PolarHBondContact CD2-NE1 3.15Å; H177-W183 AromaticContact CE1-CE2 3.99Å; H177-W183 AromaticContact CE1-CZ2 3.9Å; H177-W183 AromaticContact CE1-NE1 3.98Å; H177-W183 AromaticContact CG-CD2 3.75Å; H177-W183 AromaticContact CG-CE2 3.56Å; H177-W183 AromaticContact CG-CZ2 3.72Å; H177-W183 AromaticContact CG-NE1 3.96Å; H177-W183 AromaticContact ND1-CE2 3.97Å; H177-W183 AromaticContact ND1-CZ2 3.72Å; H177-W183 AromaticContact NE2-CD1 3.81Å; H177-W183 AromaticContact NE2-CE2 3.6Å; H177-W183 AromaticContact NE2-CZ2 4Å; H177-W183 AromaticContact NE2-NE1 3.25Å; H177-W183 PolarHBondContact NE2-NE1 3.43Å; W183-Y185 PolarHBondContact O-N 3.15Å; W183-L188 HydrophobicContact CB-CB 3.86Å; W183-L188 HydrophobicContact CD2-CB 3.67Å; W183-L188 HydrophobicContact CD2-CD1 4.11Å; W183-L188 HydrophobicContact CE3-CB 3.97Å; W183-L188 HydrophobicContact CE3-CD1 3.51Å; W183-L188 HydrophobicContact CE3-CG 4.37Å; W183-L188 HydrophobicContact CG-CB 3.61Å; W183-L188 HydrophobicContact CZ3-CD1 4.09Å; W183-E189 VanDerWaalsContact CD1-OE2 3.27Å; W183-F200 HydrophobicContact CZ3-CZ 4.3Å
184V93.2Very high95.1Very high13 Ų1366.8 Ų66.88%0.07935%0.354CS..SBendtrans-58.7-38.9175.1175.80000111.8K40 F41 T173 V176K40-V184 HydrophobicContact CB-CG1 4.38Å; K40-V184 HydrophobicContact CB-CG2 3.9Å; K40-V184 HydrophobicContact CD-CG2 4.46Å; K40-V184 HydrophobicContact CG-CG1 4.12Å; K40-V184 HydrophobicContact CG-CG2 4.23Å; K40-V184 WeakPolarHBondContact O-CG1 3.24Å; F41-V184 HydrophobicContact CD1-CG1 3.82Å; F41-V184 HydrophobicContact CE1-CG1 4.07Å; T173-V184 HydrophobicContact CG2-CB 4.12Å; T173-V184 HydrophobicContact CG2-CG2 4.02Å; V176-V184 HydrophobicContact CB-CG2 4.22Å; V176-V184 HydrophobicContact CG1-CG2 3.94Å
185Y95Very high95.1Very high40 Ų4066.5 Ų66.516%0.15736%0.355CS..SBendtrans-116.3128.3-178.6-57.5-73.4000110.6L42 V116 Y169 W183 V187 L188L42-Y185 VanDerWaalsContact CB-OH 3.29Å; L42-Y185 WeakPolarHBondContact CB-OH 3.48Å; L42-Y185 PolarHBondContact N-OH 2.86Å; V116-Y185 HydrophobicContact CG2-CD1 4.38Å; Y169-Y185 HydrophobicContact CE1-CE2 4.08Å; Y169-Y185 VanDerWaalsContact OH-CE2 3.27Å; Y169-Y185 WeakPolarHBondContact OH-CE2 3.22Å; Y169-Y185 PolarHBondContact OH-OH 3.34Å; W183-Y185 PolarHBondContact O-N 3.15Å; Y185-V187 PolarHBondContact O-N 2.73Å; Y185-V187 VanDerWaalsContact O-N 3.13Å; Y185-L188 HydrophobicContact CD2-CD1 4.36Å; Y185-L188 WeakPolarHBondContact O-CB 3.21Å; Y185-L188 PolarHBondContact O-N 3.45Å
186P94.9Very high95Very high37 Ų3762.1 Ų62.124%0.2434%0.338CS..Hα-helixtrans-55.3-30.7179.4-27.433.6000114.6E114 L115 P118 L188 E189 R190E114-P186 VanDerWaalsContact O-CB 3.24Å; E114-P186 WeakPolarHBondContact O-CB 3.35Å; L115-P186 WeakPolarHBondContact O-CD 3.47Å; P118-P186 HydrophobicContact CG-CG 3.91Å; P186-L188 PolarHBondContact O-N 3.01Å; P186-E189 WeakPolarHBondContact O-CB 3.3Å; P186-E189 PolarHBondContact O-N 3.32Å; P186-E189 VanDerWaalsContact O-N 3.07Å; P186-R190 PolarHBondContact O-N 3.3Å
187V96.3Very high95.1Very high13 Ų1366.2 Ų66.28%0.07936%0.363CS..Hα-helixtrans-53.5-36.917567.80000112.7L115 Y185 E189 R190 I191 F199L115-V187 HydrophobicContact CB-CB 4.14Å; L115-V187 HydrophobicContact CD2-CB 4.3Å; L115-V187 HydrophobicContact CD2-CG2 4.35Å; L115-V187 PolarHBondContact O-N 3.28Å; Y185-V187 PolarHBondContact O-N 2.73Å; Y185-V187 VanDerWaalsContact O-N 3.13Å; V187-E189 VanDerWaalsContact C-N 3.34Å; V187-R190 PolarHBondContact O-N 3.5Å; V187-I191 WeakPolarHBondContact O-CG1 3.39Å; V187-F199 HydrophobicContact CG1-CE1 4.29Å; V187-F199 HydrophobicContact CG1-CE2 4.43Å; V187-F199 HydrophobicContact CG1-CZ 3.89Å; V187-F199 HydrophobicContact CG2-CE2 4.08Å; V187-F199 HydrophobicContact CG2-CZ 4.37Å
188L96.1Very high95.2Very high2 Ų266.9 Ų66.91%0.0138%0.377CS..Hα-helixtrans-73.2-29.4-178.4-60.6177.3000111.7T173 W183 Y185 P186 R190 I191 R196 F199 F200T173-L188 HydrophobicContact CG2-CD1 3.82Å; W183-L188 HydrophobicContact CB-CB 3.86Å; W183-L188 HydrophobicContact CD2-CB 3.67Å; W183-L188 HydrophobicContact CD2-CD1 4.11Å; W183-L188 HydrophobicContact CE3-CB 3.97Å; W183-L188 HydrophobicContact CE3-CD1 3.51Å; W183-L188 HydrophobicContact CE3-CG 4.37Å; W183-L188 HydrophobicContact CG-CB 3.61Å; W183-L188 HydrophobicContact CZ3-CD1 4.09Å; Y185-L188 HydrophobicContact CD2-CD1 4.36Å; Y185-L188 WeakPolarHBondContact O-CB 3.21Å; Y185-L188 PolarHBondContact O-N 3.45Å; P186-L188 PolarHBondContact O-N 3.01Å; L188-R190 VanDerWaalsContact C-N 3.34Å; L188-I191 HydrophobicContact CD2-CD1 4.24Å; L188-R196 VanDerWaalsContact O-CZ 3.23Å; L188-R196 PolarHBondContact O-NE 2.93Å; L188-R196 PolarHBondContact O-NH2 2.96Å; L188-F199 HydrophobicContact CD2-CD1 3.74Å; L188-F199 HydrophobicContact CD2-CE1 3.94Å; L188-F200 HydrophobicContact CD1-CE1 4.01Å; L188-F200 HydrophobicContact CD1-CZ 3.99Å; L188-F200 HydrophobicContact CD2-CE1 3.8Å; L188-F200 HydrophobicContact CD2-CZ 3.92Å
189E94.8Very high95.3Very high109 Ų10962 Ų6251%0.50935%0.353SS..Hα-helixtrans-66.1-39.8173.8-168.162.5-12800110.9W183 P186 V187 I191W183-E189 VanDerWaalsContact CD1-OE2 3.27Å; P186-E189 WeakPolarHBondContact O-CB 3.3Å; P186-E189 PolarHBondContact O-N 3.32Å; P186-E189 VanDerWaalsContact O-N 3.07Å; V187-E189 VanDerWaalsContact C-N 3.34Å; E189-I191 VanDerWaalsContact C-N 3.34Å; E189-I191 PolarHBondContact O-N 3.49Å
190R93.7Very high95.4Very high143 Ų14360.2 Ų60.254%0.5434%0.34SS..SBendtrans-78.8-9.7-172-63.6-173.3-173.7178.12.2115.2D112 E114 P186 V187 L188D112-R190 IonicContact OD2-NH1 2.74Å; D112-R190 PolarHBondContact OD2-NH1 2.96Å; E114-R190 VanDerWaalsContact CB-NH2 3.32Å; P186-R190 PolarHBondContact O-N 3.3Å; V187-R190 PolarHBondContact O-N 3.5Å; L188-R190 VanDerWaalsContact C-N 3.34Å
191I95.2Very high95.6Very high45 Ų4561 Ų6123%0.23135%0.348CS..SBendtrans-113.7148.6-174.264.5177.8000112V187 L188 E189 A195 R196 F199V187-I191 WeakPolarHBondContact O-CG1 3.39Å; L188-I191 HydrophobicContact CD2-CD1 4.24Å; E189-I191 VanDerWaalsContact C-N 3.34Å; E189-I191 PolarHBondContact O-N 3.49Å; I191-A195 HydrophobicContact CB-CB 3.95Å; I191-R196 HydrophobicContact CD1-CB 4.37Å; I191-R196 HydrophobicContact CD1-CG 3.79Å; I191-R196 HydrophobicContact CG1-CG 3.59Å; I191-R196 PolarHBondContact O-NE 2.83Å; I191-R196 PolarHBondContact O-NH2 3.33Å; I191-F199 HydrophobicContact CD1-CB 3.94Å; I191-F199 HydrophobicContact CD1-CG 4.2Å
192T96.4Very high95.8Very high90 Ų9060.9 Ų60.955%0.55234%0.341SS*.  trans-66.1159.3179.465.80000111.6L194 A195 R196T192-L194 VanDerWaalsContact C-N 3.27Å; T192-L194 PolarHBondContact O-N 3.48Å; T192-A195 CarbonylContact O-C 3.56Å; T192-A195 WeakPolarHBondContact O-CA 3.18Å; T192-A195 WeakPolarHBondContact O-CB 3.31Å; T192-A195 PolarHBondContact O-N 3.43Å; T192-A195 WeakPolarHBondContact OG1-CB 3.3Å; T192-A195 PolarHBondContact OG1-N 2.83Å; T192-R196 WeakPolarHBondContact O-CG 3.48Å; T192-R196 PolarHBondContact O-N 3.38Å
193P95.2Very high96.1Very high91 Ų9158.4 Ų58.459%0.59132%0.324SS*.Hα-helixtrans-53.5-40.5178.8-27.734.9000114.2R196 V197P193-R196 WeakPolarHBondContact O-CB 3.45Å; P193-R196 PolarHBondContact O-N 2.84Å; P193-V197 PolarHBondContact O-N 3.31Å
194L95.9Very high96.2Very high141 Ų14158.4 Ų58.474%0.73833%0.327SS*.Hα-helixtrans-65.2-42176.4-177.461.1000111.6T192 R196 V197 A198T192-L194 VanDerWaalsContact C-N 3.27Å; T192-L194 PolarHBondContact O-N 3.48Å; L194-R196 VanDerWaalsContact C-N 3.29Å; L194-R196 PolarHBondContact O-N 3.35Å; L194-V197 PolarHBondContact O-N 3.39Å; L194-A198 PolarHBondContact O-N 2.99Å
195A96.6Very high96.5Very high37 Ų3760.2 Ų60.231%0.30634%0.344SS..Hα-helixtrans-65.1-30.7175.100000112.4I191 T192 A198 F199I191-A195 HydrophobicContact CB-CB 3.95Å; T192-A195 CarbonylContact O-C 3.56Å; T192-A195 WeakPolarHBondContact O-CA 3.18Å; T192-A195 WeakPolarHBondContact O-CB 3.31Å; T192-A195 PolarHBondContact O-N 3.43Å; T192-A195 WeakPolarHBondContact OG1-CB 3.3Å; T192-A195 PolarHBondContact OG1-N 2.83Å; A195-A198 PolarHBondContact O-N 2.95Å; A195-F199 VanDerWaalsContact O-CB 3.27Å; A195-F199 WeakPolarHBondContact O-CB 3.35Å; A195-F199 PolarHBondContact O-N 3Å
196R97.1Very high96.6Very high45 Ų4559.7 Ų59.717%0.1735%0.345CS..Hα-helixtrans-62.6-43.5172.5-64.4176.3-175126.32.6111.9L188 I191 T192 P193 L194 A198 F199 F200L188-R196 VanDerWaalsContact O-CZ 3.23Å; L188-R196 PolarHBondContact O-NE 2.93Å; L188-R196 PolarHBondContact O-NH2 2.96Å; I191-R196 HydrophobicContact CD1-CB 4.37Å; I191-R196 HydrophobicContact CD1-CG 3.79Å; I191-R196 HydrophobicContact CG1-CG 3.59Å; I191-R196 PolarHBondContact O-NE 2.83Å; I191-R196 PolarHBondContact O-NH2 3.33Å; T192-R196 WeakPolarHBondContact O-CG 3.48Å; T192-R196 PolarHBondContact O-N 3.38Å; P193-R196 WeakPolarHBondContact O-CB 3.45Å; P193-R196 PolarHBondContact O-N 2.84Å; L194-R196 VanDerWaalsContact C-N 3.29Å; L194-R196 PolarHBondContact O-N 3.35Å; R196-A198 VanDerWaalsContact C-N 3.34Å; R196-A198 PolarHBondContact O-N 2.9Å; R196-F199 PolarHBondContact O-N 3.39Å; R196-F200 HydrophobicContact CB-CE2 4.26Å; R196-F200 WeakPolarHBondContact O-CD2 3.36Å; R196-F200 WeakPolarHBondContact O-CG 3.34Å; R196-F200 PolarHBondContact O-N 3.41Å
197V96.9Very high96.8Very high89 Ų8958.2 Ų58.254%0.53934%0.335SS..Hα-helixtrans-62.2-43.9177.2177.20000110.7P193 L194 F200 S201P193-V197 PolarHBondContact O-N 3.31Å; L194-V197 PolarHBondContact O-N 3.39Å; V197-F200 PolarHBondContact O-N 3.4Å; V197-S201 WeakPolarHBondContact O-CB 3.25Å; V197-S201 PolarHBondContact O-N 2.99Å; V197-S201 PolarHBondContact O-OG 3.22Å
198A97.9Very high96.9Very high61 Ų6158.8 Ų58.850%0.50434%0.339SS..Hα-helixtrans-63.1-43.2175.200000111.6L194 A195 R196 S201 A202L194-A198 PolarHBondContact O-N 2.99Å; A195-A198 PolarHBondContact O-N 2.95Å; R196-A198 VanDerWaalsContact C-N 3.34Å; R196-A198 PolarHBondContact O-N 2.9Å; A198-S201 PolarHBondContact O-N 3.47Å; A198-A202 WeakPolarHBondContact O-CB 3.48Å; A198-A202 PolarHBondContact O-N 3.22Å
199F97Very high97Very high47 Ų4763.1 Ų63.121%0.20636%0.361CS..Hα-helixtrans-61-48.4177.2-176.7-92.1000111.9V187 L188 I191 A195 R196 S201 A202 M203V187-F199 HydrophobicContact CG1-CE1 4.29Å; V187-F199 HydrophobicContact CG1-CE2 4.43Å; V187-F199 HydrophobicContact CG1-CZ 3.89Å; V187-F199 HydrophobicContact CG2-CE2 4.08Å; V187-F199 HydrophobicContact CG2-CZ 4.37Å; L188-F199 HydrophobicContact CD2-CD1 3.74Å; L188-F199 HydrophobicContact CD2-CE1 3.94Å; I191-F199 HydrophobicContact CD1-CB 3.94Å; I191-F199 HydrophobicContact CD1-CG 4.2Å; A195-F199 VanDerWaalsContact O-CB 3.27Å; A195-F199 WeakPolarHBondContact O-CB 3.35Å; A195-F199 PolarHBondContact O-N 3Å; R196-F199 PolarHBondContact O-N 3.39Å; F199-S201 VanDerWaalsContact C-N 3.33Å; F199-S201 PolarHBondContact O-N 3.47Å; F199-A202 PolarHBondContact O-N 3.3Å; F199-M203 HydrophobicContact CD1-CG 4.08Å; F199-M203 HydrophobicContact CD2-CE 4.21Å; F199-M203 HydrophobicContact CE1-CE 4.44Å; F199-M203 HydrophobicContact CE1-CG 3.74Å; F199-M203 HydrophobicContact CE2-CE 3.69Å; F199-M203 HydrophobicContact CZ-CE 3.82Å; F199-M203 HydrophobicContact CZ-CG 4.03Å; F199-M203 HydrophobicContact CZ-SD 4.24Å; F199-M203 WeakPolarHBondContact O-CG 3.39Å; F199-M203 PolarHBondContact O-N 3.35Å
200F97.8Very high97.2Very high33 Ų3359 Ų5915%0.14534%0.343CS..Hα-helixtrans-62.9-39.2176.9-68.6-39000112.7I170 W183 L188 R196 V197 M203 T204I170-F200 HydrophobicContact CD1-CB 3.98Å; I170-F200 HydrophobicContact CD1-CD1 4.35Å; I170-F200 HydrophobicContact CD1-CG 4.36Å; I170-F200 HydrophobicContact CG1-CB 4.46Å; I170-F200 HydrophobicContact CG1-CD1 3.94Å; I170-F200 HydrophobicContact CG1-CE1 4.49Å; I170-F200 HydrophobicContact CG1-CG 4.3Å; I170-F200 HydrophobicContact CG2-CB 4.36Å; I170-F200 HydrophobicContact CG2-CD1 4.01Å; I170-F200 HydrophobicContact CG2-CD2 3.9Å; I170-F200 HydrophobicContact CG2-CE1 4.24Å; I170-F200 HydrophobicContact CG2-CE2 4.13Å; I170-F200 HydrophobicContact CG2-CG 3.85Å; I170-F200 HydrophobicContact CG2-CZ 4.29Å; W183-F200 HydrophobicContact CZ3-CZ 4.3Å; L188-F200 HydrophobicContact CD1-CE1 4.01Å; L188-F200 HydrophobicContact CD1-CZ 3.99Å; L188-F200 HydrophobicContact CD2-CE1 3.8Å; L188-F200 HydrophobicContact CD2-CZ 3.92Å; R196-F200 HydrophobicContact CB-CE2 4.26Å; R196-F200 WeakPolarHBondContact O-CD2 3.36Å; R196-F200 WeakPolarHBondContact O-CG 3.34Å; R196-F200 PolarHBondContact O-N 3.41Å; V197-F200 PolarHBondContact O-N 3.4Å; F200-M203 PolarHBondContact O-N 2.84Å; F200-T204 WeakPolarHBondContact O-CB 3.41Å; F200-T204 PolarHBondContact O-N 2.98Å; F200-T204 PolarHBondContact O-OG1 3.39Å
201S97.6Very high97.4Very high72 Ų7252.2 Ų52.250%0.50332%0.317SS..Hα-helixtrans-62.4-44.6174.6-57.30000111.1V197 A198 F199 T204 A205V197-S201 WeakPolarHBondContact O-CB 3.25Å; V197-S201 PolarHBondContact O-N 2.99Å; V197-S201 PolarHBondContact O-OG 3.22Å; A198-S201 PolarHBondContact O-N 3.47Å; F199-S201 VanDerWaalsContact C-N 3.33Å; F199-S201 PolarHBondContact O-N 3.47Å; S201-T204 PolarHBondContact O-N 3.28Å; S201-A205 PolarHBondContact O-N 3.24Å
202A97.9Very high97.5Very high48 Ų4852 Ų5240%0.39732%0.317SS..Hα-helixtrans-63.2-46.1177.300000111.8A198 F199 T204 A205 V206A198-A202 WeakPolarHBondContact O-CB 3.48Å; A198-A202 PolarHBondContact O-N 3.22Å; F199-A202 PolarHBondContact O-N 3.3Å; A202-T204 VanDerWaalsContact C-N 3.3Å; A202-T204 PolarHBondContact O-N 3.4Å; A202-A205 WeakPolarHBondContact O-CB 3.42Å; A202-A205 PolarHBondContact O-N 2.81Å; A202-A205 VanDerWaalsContact O-N 3.14Å; A202-V206 WeakPolarHBondContact O-CG2 3.31Å; A202-V206 PolarHBondContact O-N 2.59Å
203M97.6Very high97.6Very high42 Ų4251.8 Ų51.821%0.20731%0.312CS..Hα-helixtrans-61.6-38.8176.6-68-56.4128.600112.2F100 T104 F199 F200 A205 V206 I207F100-M203 HydrophobicContact CE2-CB 4.17Å; F100-M203 WeakPolarHBondContact CE2-O 3.45Å; F100-M203 HydrophobicContact CE2-SD 4.04Å; F100-M203 HydrophobicContact CZ-CB 3.96Å; F100-M203 HydrophobicContact CZ-CG 4.29Å; F100-M203 HydrophobicContact CZ-SD 3.84Å; T104-M203 HydrophobicContact CG2-SD 3.84Å; F199-M203 HydrophobicContact CD1-CG 4.08Å; F199-M203 HydrophobicContact CD2-CE 4.21Å; F199-M203 HydrophobicContact CE1-CE 4.44Å; F199-M203 HydrophobicContact CE1-CG 3.74Å; F199-M203 HydrophobicContact CE2-CE 3.69Å; F199-M203 HydrophobicContact CZ-CE 3.82Å; F199-M203 HydrophobicContact CZ-CG 4.03Å; F199-M203 HydrophobicContact CZ-SD 4.24Å; F199-M203 WeakPolarHBondContact O-CG 3.39Å; F199-M203 PolarHBondContact O-N 3.35Å; F200-M203 PolarHBondContact O-N 2.84Å; M203-A205 VanDerWaalsContact C-N 3.35Å; M203-V206 PolarHBondContact O-N 3.48Å; M203-I207 PolarHBondContact O-N 3.31Å
204T97.8Very high97.7Very high28 Ų2847.4 Ų47.417%0.17228%0.284CS..Hα-helixtrans-63.8-40174.6-55.60000111.5I170 F200 S201 A202 I207 C208I170-T204 WeakPolarHBondContact CD1-OG1 3.38Å; F200-T204 WeakPolarHBondContact O-CB 3.41Å; F200-T204 PolarHBondContact O-N 2.98Å; F200-T204 PolarHBondContact O-OG1 3.39Å; S201-T204 PolarHBondContact O-N 3.28Å; A202-T204 VanDerWaalsContact C-N 3.3Å; A202-T204 PolarHBondContact O-N 3.4Å; T204-I207 VanDerWaalsContact O-CG2 3.22Å; T204-I207 WeakPolarHBondContact O-CG2 3.3Å; T204-C208 PolarHBondContact O-N 3.42Å; T204-C208 PolarHBondContact O-SG 3.36Å
205A98.3Very high97.7Very high51 Ų5142.4 Ų42.442%0.42126%0.257SS..Hα-helixtrans-64.9-41.7173.900000111.9S201 A202 M203 C208 I209S201-A205 PolarHBondContact O-N 3.24Å; A202-A205 WeakPolarHBondContact O-CB 3.42Å; A202-A205 PolarHBondContact O-N 2.81Å; A202-A205 VanDerWaalsContact O-N 3.14Å; M203-A205 VanDerWaalsContact C-N 3.35Å; A205-C208 WeakPolarHBondContact O-CB 3.4Å; A205-C208 PolarHBondContact O-N 3.34Å; A205-I209 WeakPolarHBondContact O-CG1 3.37Å; A205-I209 PolarHBondContact O-N 3.4Å
206V98.3Very high97.7Very high29 Ų2945.3 Ų45.318%0.17627%0.266CS..Hα-helixtrans-61.5-46178.8174.30000111.3F100 F103 A202 M203 C208 I209 M210F100-V206 HydrophobicContact CD2-CB 4.25Å; F100-V206 HydrophobicContact CD2-CG1 3.81Å; F100-V206 HydrophobicContact CE2-CB 4.08Å; F100-V206 HydrophobicContact CE2-CG1 4.01Å; F103-V206 HydrophobicContact CD1-CG1 3.88Å; F103-V206 HydrophobicContact CE1-CG1 3.99Å; A202-V206 WeakPolarHBondContact O-CG2 3.31Å; A202-V206 PolarHBondContact O-N 2.59Å; M203-V206 PolarHBondContact O-N 3.48Å; V206-C208 VanDerWaalsContact C-N 3.29Å; V206-C208 PolarHBondContact O-N 3.07Å; V206-I209 WeakPolarHBondContact O-CB 3.41Å; V206-I209 PolarHBondContact O-N 3.15Å; V206-I209 VanDerWaalsContact O-N 3.12Å; V206-M210 HydrophobicContact CG1-CE 4.01Å; V206-M210 WeakPolarHBondContact O-CG 3.49Å; V206-M210 PolarHBondContact O-N 2.9Å
207I98.3Very high97.6Very high6 Ų645.9 Ų45.93%0.03127%0.272CS..Hα-helixtrans-65.5-32.7178.7-162.9175.9000112.2P96 V97 F100 V162 F165 M203 T204 M210 Y211P96-I207 HydrophobicContact CB-CG1 4.35Å; V97-I207 HydrophobicContact CG2-CD1 4.21Å; F100-I207 HydrophobicContact CB-CB 4.46Å; F100-I207 HydrophobicContact CB-CG1 4.12Å; F100-I207 HydrophobicContact CD2-CB 3.7Å; F100-I207 HydrophobicContact CD2-CG1 4.25Å; F100-I207 HydrophobicContact CE2-CB 4.21Å; F100-I207 HydrophobicContact CG-CB 4.18Å; F100-I207 HydrophobicContact CG-CD1 4.49Å; F100-I207 HydrophobicContact CG-CG1 4.23Å; V162-I207 HydrophobicContact CG1-CB 4.25Å; V162-I207 HydrophobicContact CG1-CD1 3.93Å; V162-I207 HydrophobicContact CG1-CG1 3.63Å; V162-I207 HydrophobicContact CG1-CG2 3.92Å; F165-I207 HydrophobicContact CD1-CD1 4.38Å; M203-I207 PolarHBondContact O-N 3.31Å; T204-I207 VanDerWaalsContact O-CG2 3.22Å; T204-I207 WeakPolarHBondContact O-CG2 3.3Å; I207-M210 PolarHBondContact O-N 2.8Å; I207-Y211 PolarHBondContact O-N 2.65Å
208C98.3Very high97.4Very high25 Ų2542 Ų4217%0.16925%0.248CC..Hα-helixtrans-64.7-40.9171.3-67.20000112.2L159 C163 T204 A205 V206 M210 Y211 V212L159-C208 HydrophobicContact CD2-CB 3.85Å; C163-C208 PolarHBondContact SG-SG 3.38Å; T204-C208 PolarHBondContact O-N 3.42Å; T204-C208 PolarHBondContact O-SG 3.36Å; A205-C208 WeakPolarHBondContact O-CB 3.4Å; A205-C208 PolarHBondContact O-N 3.34Å; V206-C208 VanDerWaalsContact C-N 3.29Å; V206-C208 PolarHBondContact O-N 3.07Å; C208-M210 VanDerWaalsContact C-N 3.32Å; C208-Y211 WeakPolarHBondContact O-CB 3.32Å; C208-Y211 PolarHBondContact O-N 2.84Å; C208-V212 PolarHBondContact O-N 2.91Å; C208-V212 VanDerWaalsContact O-N 3.15Å
209I98.4Very high97.2Very high94 Ų9439.9 Ų39.948%0.48223%0.233SC..Hα-helixtrans-61-44.2173.6-69.7159.5000109.8A205 V206 Y211 V212 L213A205-I209 WeakPolarHBondContact O-CG1 3.37Å; A205-I209 PolarHBondContact O-N 3.4Å; V206-I209 WeakPolarHBondContact O-CB 3.41Å; V206-I209 PolarHBondContact O-N 3.15Å; V206-I209 VanDerWaalsContact O-N 3.12Å; I209-Y211 VanDerWaalsContact C-N 3.31Å; I209-Y211 PolarHBondContact O-N 2.73Å; I209-V212 PolarHBondContact O-N 2.89Å; I209-V212 VanDerWaalsContact O-N 3.15Å; I209-L213 HydrophobicContact CG2-CD1 3.87Å; I209-L213 HydrophobicContact CG2-CG 4.15Å; I209-L213 WeakPolarHBondContact O-CG 3.42Å; I209-L213 PolarHBondContact O-N 3.29Å
210M98.2Very high96.9Very high23 Ų2344.4 Ų44.411%0.11325%0.25CC..Hα-helixtrans-60.2-38.8177.4-63.6-56.4138.500112.4F95 P96 A99 F100 F103 V206 I207 C208 L213 G214F95-M210 WeakPolarHBondContact CE1-O 3.18Å; P96-M210 HydrophobicContact CB-CB 4.41Å; A99-M210 HydrophobicContact CB-CB 4.28Å; A99-M210 HydrophobicContact CB-CG 4.23Å; A99-M210 HydrophobicContact CB-SD 4.01Å; F100-M210 HydrophobicContact CB-CG 4.33Å; F103-M210 HydrophobicContact CD1-CE 4.18Å; F103-M210 HydrophobicContact CG-CE 4.18Å; V206-M210 HydrophobicContact CG1-CE 4.01Å; V206-M210 WeakPolarHBondContact O-CG 3.49Å; V206-M210 PolarHBondContact O-N 2.9Å; I207-M210 PolarHBondContact O-N 2.8Å; C208-M210 VanDerWaalsContact C-N 3.32Å; M210-L213 HydrophobicContact CE-CD1 4.25Å; M210-L213 PolarHBondContact O-N 3.16Å; M210-L213 HydrophobicContact SD-CD1 4.09Å; M210-G214 PolarHBondContact O-N 3.05Å
211Y98.3Very high96.6Very high0 Ų043.5 Ų43.50%025%0.246CC..Hα-helixtrans-58.4-50.6172.3172.7-87.9000112A91 Y152 P153 R155 L159 V162 I207 C208 I209 L213 G214 E215A91-Y211 VanDerWaalsContact O-CD2 3.25Å; A91-Y211 WeakPolarHBondContact O-CD2 3.48Å; Y152-Y211 HydrophobicContact CD1-CE2 4.06Å; Y152-Y211 HydrophobicContact CE1-CE2 4.24Å; P153-Y211 PolarHBondContact O-OH 3.33Å; R155-Y211 HydrophobicContact CG-CE1 4.18Å; L159-Y211 HydrophobicContact CD2-CD1 3.64Å; L159-Y211 HydrophobicContact CD2-CE1 4.42Å; L159-Y211 HydrophobicContact CD2-CG 4.19Å; L159-Y211 HydrophobicContact CG-CD1 3.89Å; L159-Y211 HydrophobicContact CG-CE1 4.17Å; V162-Y211 HydrophobicContact CG2-CD2 3.71Å; V162-Y211 HydrophobicContact CG2-CG 4.17Å; I207-Y211 PolarHBondContact O-N 2.65Å; C208-Y211 WeakPolarHBondContact O-CB 3.32Å; C208-Y211 PolarHBondContact O-N 2.84Å; I209-Y211 VanDerWaalsContact C-N 3.31Å; I209-Y211 PolarHBondContact O-N 2.73Å; Y211-L213 VanDerWaalsContact C-N 3.32Å; Y211-L213 PolarHBondContact O-N 3.42Å; Y211-G214 PolarHBondContact O-N 3.49Å; Y211-G214 VanDerWaalsContact O-N 3.15Å; Y211-E215 PolarHBondContact O-N 3.05Å
212V98.2Very high96.2Very high39 Ų3943 Ų4324%0.23623%0.233CC..Hα-helixtrans-63.8-39.8-178.9176.40000111L159 C208 I209 G214 E215 I216L159-V212 HydrophobicContact CD2-CG2 4.23Å; C208-V212 PolarHBondContact O-N 2.91Å; C208-V212 VanDerWaalsContact O-N 3.15Å; I209-V212 PolarHBondContact O-N 2.89Å; I209-V212 VanDerWaalsContact O-N 3.15Å; V212-G214 VanDerWaalsContact C-N 3.32Å; V212-G214 PolarHBondContact O-N 2.98Å; V212-E215 PolarHBondContact O-N 3.2Å; V212-I216 HydrophobicContact CG1-CD1 3.81Å; V212-I216 HydrophobicContact CG1-CG1 4.41Å; V212-I216 VanDerWaalsContact O-CG1 3.31Å; V212-I216 WeakPolarHBondContact O-CG1 3.35Å; V212-I216 PolarHBondContact O-N 2.93Å
213L97.6Very high95.3Very high86 Ų8645.5 Ų45.545%0.4524%0.24SC..Hα-helixtrans-61.3-40.5174.4-71.3175.6000111.8I209 M210 Y211 I216 L217I209-L213 HydrophobicContact CG2-CD1 3.87Å; I209-L213 HydrophobicContact CG2-CG 4.15Å; I209-L213 WeakPolarHBondContact O-CG 3.42Å; I209-L213 PolarHBondContact O-N 3.29Å; M210-L213 HydrophobicContact CE-CD1 4.25Å; M210-L213 PolarHBondContact O-N 3.16Å; M210-L213 HydrophobicContact SD-CD1 4.09Å; Y211-L213 VanDerWaalsContact C-N 3.32Å; Y211-L213 PolarHBondContact O-N 3.42Å; L213-I216 PolarHBondContact O-N 3.49Å; L213-L217 WeakPolarHBondContact O-CB 3.49Å; L213-L217 PolarHBondContact O-N 3.27Å
214G97.1Very high93.4Very high0 Ų048 Ų480%025%0.251CS..Hα-helixtrans-63.3-43.6175.700000113F95 Y152 M210 Y211 V212 L217 N218F95-G214 VanDerWaalsContact CD1-CA 3.43Å; F95-G214 VanDerWaalsContact CE1-N 3.33Å; Y152-G214 PolarHBondContact OH-O 2.87Å; M210-G214 PolarHBondContact O-N 3.05Å; Y211-G214 PolarHBondContact O-N 3.49Å; Y211-G214 VanDerWaalsContact O-N 3.15Å; V212-G214 VanDerWaalsContact C-N 3.32Å; V212-G214 PolarHBondContact O-N 2.98Å; G214-L217 PolarHBondContact O-N 3.45Å; G214-N218 VanDerWaalsContact O-CB 3.3Å; G214-N218 WeakPolarHBondContact O-CB 3.2Å; G214-N218 PolarHBondContact O-N 3.16Å
215E96.8Very high91.4Very high35 Ų3549.4 Ų49.416%0.16426%0.26CS..Hα-helixtrans-61.5-47.2176.7-171-174.6-111.500111.2Y152 R155 Y211 V212 G219Y152-E215 HydrophobicContact CD1-CB 3.64Å; Y152-E215 HydrophobicContact CD1-CG 3.84Å; Y152-E215 HydrophobicContact CE1-CB 3.8Å; Y152-E215 HydrophobicContact CE1-CG 4.48Å; Y152-E215 HydrophobicContact CG-CB 4.26Å; Y152-E215 HydrophobicContact CG-CG 4.06Å; R155-E215 IonicContact CZ-OE2 2.73Å; R155-E215 IonicContact NE-OE1 2.67Å; R155-E215 IonicContact NE-OE2 3.9Å; R155-E215 PolarHBondContact NE-OE2 2.86Å; R155-E215 IonicContact NH2-OE2 2.72Å; R155-E215 PolarHBondContact NH2-OE2 3.25Å; Y211-E215 PolarHBondContact O-N 3.05Å; V212-E215 PolarHBondContact O-N 3.2Å; E215-G219 PolarHBondContact O-N 2.96Å
216I95.7Very high89.2Confident98 Ų9853 Ų5350%0.50327%0.267SS..Hα-helixtrans-63.9-45.7177.4-67.8168.4000111V212 L213 N218 G219 Y220V212-I216 HydrophobicContact CG1-CD1 3.81Å; V212-I216 HydrophobicContact CG1-CG1 4.41Å; V212-I216 VanDerWaalsContact O-CG1 3.31Å; V212-I216 WeakPolarHBondContact O-CG1 3.35Å; V212-I216 PolarHBondContact O-N 2.93Å; L213-I216 PolarHBondContact O-N 3.49Å; I216-N218 PolarHBondContact O-N 2.81Å; I216-G219 PolarHBondContact O-N 3.39Å; I216-Y220 WeakPolarHBondContact O-CB 3.47Å; I216-Y220 PolarHBondContact O-N 3.46Å
217L95.1Very high86.9Confident57 Ų5755 Ų5530%0.29828%0.28SS..Hα-helixtrans-62.9-44.1-178.7-179.162.1000111.1F95 I142 M145 L213 G214 Y220 I221F95-L217 HydrophobicContact CE2-CD2 4.22Å; F95-L217 HydrophobicContact CZ-CD2 4.22Å; I142-L217 HydrophobicContact CG1-CD2 4.46Å; M145-L217 HydrophobicContact SD-CB 4.09Å; M145-L217 HydrophobicContact SD-CD2 3.86Å; M145-L217 HydrophobicContact SD-CG 3.75Å; L213-L217 WeakPolarHBondContact O-CB 3.49Å; L213-L217 PolarHBondContact O-N 3.27Å; G214-L217 PolarHBondContact O-N 3.45Å; L217-Y220 PolarHBondContact O-N 2.79Å; L217-I221 HydrophobicContact CD1-CD1 4.05Å; L217-I221 HydrophobicContact CD1-CG1 4.3Å; L217-I221 HydrophobicContact CG-CD1 3.86Å; L217-I221 WeakPolarHBondContact O-CB 3.33Å; L217-I221 WeakPolarHBondContact O-CD1 3.46Å; L217-I221 WeakPolarHBondContact O-CG1 3.49Å; L217-I221 PolarHBondContact O-N 3.15Å
218N94.4Very high84.6Confident7 Ų761.7 Ų61.74%0.03731%0.311CS..Hα-helixtrans-62.2-45176.6-177.384.3000111.3M145 H150 Y152 G214 I216 I221 W222M145-N218 HydrophobicContact CG-CB 4.08Å; M145-N218 HydrophobicContact SD-CB 3.8Å; H150-N218 PolarHBondContact N-OD1 3.2Å; H150-N218 PolarHBondContact O-ND2 2.92Å; Y152-N218 HydrophobicContact CD2-CB 4.23Å; Y152-N218 HydrophobicContact CE2-CB 3.64Å; G214-N218 VanDerWaalsContact O-CB 3.3Å; G214-N218 WeakPolarHBondContact O-CB 3.2Å; G214-N218 PolarHBondContact O-N 3.16Å; I216-N218 PolarHBondContact O-N 2.81Å; N218-I221 PolarHBondContact O-N 2.99Å; N218-W222 VanDerWaalsContact O-CD1 3.29Å; N218-W222 PolarHBondContact O-N 3.5Å
219G91.8Very high82.3Confident18 Ų1867.4 Ų67.419%0.18633%0.333CS..Hα-helixtrans-59.4-50174.200000112.1E215 I216 I221 W222 D223E215-G219 PolarHBondContact O-N 2.96Å; I216-G219 PolarHBondContact O-N 3.39Å; G219-I221 VanDerWaalsContact C-N 3.34Å; G219-I221 PolarHBondContact O-N 3.46Å; G219-W222 PolarHBondContact O-N 3.02Å; G219-W222 VanDerWaalsContact O-N 3.16Å; G219-D223 WeakPolarHBondContact O-CB 3.28Å; G219-D223 VanDerWaalsContact O-CG 3.22Å; G219-D223 PolarHBondContact O-N 2.94Å
220Y92.4Very high80.1Confident142 Ų14268 Ų6856%0.55734%0.341SS*.Hα-helixtrans-58.3-42.7179.2-179.1-95.7000113I216 L217 W222 H224I216-Y220 WeakPolarHBondContact O-CB 3.47Å; I216-Y220 PolarHBondContact O-N 3.46Å; L217-Y220 PolarHBondContact O-N 2.79Å; Y220-W222 VanDerWaalsContact C-N 3.29Å; Y220-W222 PolarHBondContact O-N 3.39Å; Y220-H224 AromaticContact CD2-CD2 3.3Å; Y220-H224 WeakPolarHBondContact CD2-CD2 3.47Å; Y220-H224 AromaticContact CD2-NE2 3.48Å; Y220-H224 WeakPolarHBondContact CD2-NE2 3.29Å; Y220-H224 AromaticContact CE2-CD2 3.24Å; Y220-H224 WeakPolarHBondContact CE2-CD2 3.33Å; Y220-H224 AromaticContact CE2-NE2 3.2Å; Y220-H224 WeakPolarHBondContact CE2-NE2 3.26Å; Y220-H224 AromaticContact CZ-CD2 3.91Å; Y220-H224 PolarHBondContact O-CD2 3.21Å
221I90.8Very high77.7Confident13 Ų1375.3 Ų75.37%0.06737%0.372CS..Hα-helixtrans-60.5-39.7179.4-72.9165.4000111.3M145 R146 L217 N218 G219 T225M145-I221 HydrophobicContact CB-CD1 4.42Å; M145-I221 HydrophobicContact CG-CD1 3.93Å; M145-I221 HydrophobicContact SD-CD1 3.88Å; R146-I221 HydrophobicContact CG-CD1 4.11Å; L217-I221 HydrophobicContact CD1-CD1 4.05Å; L217-I221 HydrophobicContact CD1-CG1 4.3Å; L217-I221 HydrophobicContact CG-CD1 3.86Å; L217-I221 WeakPolarHBondContact O-CB 3.33Å; L217-I221 WeakPolarHBondContact O-CD1 3.46Å; L217-I221 WeakPolarHBondContact O-CG1 3.49Å; L217-I221 PolarHBondContact O-N 3.15Å; N218-I221 PolarHBondContact O-N 2.99Å; G219-I221 VanDerWaalsContact C-N 3.34Å; G219-I221 PolarHBondContact O-N 3.46Å; I221-T225 PolarHBondContact O-OG1 3.42Å
222W88.5Confident75.2Confident61 Ų6178.7 Ų78.723%0.23141%0.407CS..Hα-helixtrans-102.6-33.7-168.5-69.699.7000114.2M145 R146 T148 H149 N218 G219 Y220 T225 H226M145-W222 PolarHBondContact O-NE1 2.88Å; R146-W222 WeakPolarHBondContact O-CZ2 3.39Å; T148-W222 PolarHBondContact O-NE1 3.29Å; H149-W222 HydrophobicContact CB-CD2 3.66Å; H149-W222 HydrophobicContact CB-CE3 4.07Å; H149-W222 HydrophobicContact CB-CG 3.92Å; H149-W222 HydrophobicContact CB-CZ2 4.28Å; H149-W222 VanDerWaalsContact CD2-CB 3.49Å; H149-W222 WeakPolarHBondContact CD2-CB 3.47Å; H149-W222 AromaticContact CD2-CD1 3.52Å; H149-W222 AromaticContact CD2-CG 3.38Å; H149-W222 AromaticContact CG-CG 3.97Å; H149-W222 VanDerWaalsContact N-CZ2 3.28Å; N218-W222 VanDerWaalsContact O-CD1 3.29Å; N218-W222 PolarHBondContact O-N 3.5Å; G219-W222 PolarHBondContact O-N 3.02Å; G219-W222 VanDerWaalsContact O-N 3.16Å; Y220-W222 VanDerWaalsContact C-N 3.29Å; Y220-W222 PolarHBondContact O-N 3.39Å; W222-T225 WeakPolarHBondContact CA-OG1 3.17Å; W222-T225 PolarHBondContact O-N 2.78Å; W222-T225 PolarHBondContact O-OG1 3.37Å; W222-H226 PolarHBondContact O-N 3.46Å
223D79.3Confident72.6Confident101 Ų10187.7 Ų87.754%0.5445%0.446SS..Hα-helixtrans-69.1-36.6178.9-67.2-23.1000112.3G219 H226 T227G219-D223 WeakPolarHBondContact O-CB 3.28Å; G219-D223 VanDerWaalsContact O-CG 3.22Å; G219-D223 PolarHBondContact O-N 2.94Å; D223-H226 PolarHBondContact O-N 3.34Å; D223-T227 PolarHBondContact O-N 3.45Å; D223-T227 PolarHBondContact O-OG1 3.3Å
224H59.1Low71.3Confident94 Ų9487.8 Ų87.844%0.43545%0.446SS..Hα-helixtrans-67.3-38.9175-85.3-73.4000112.6Y220 H226 T227 E228Y220-H224 AromaticContact CD2-CD2 3.3Å; Y220-H224 WeakPolarHBondContact CD2-CD2 3.47Å; Y220-H224 AromaticContact CD2-NE2 3.48Å; Y220-H224 WeakPolarHBondContact CD2-NE2 3.29Å; Y220-H224 AromaticContact CE2-CD2 3.24Å; Y220-H224 WeakPolarHBondContact CE2-CD2 3.33Å; Y220-H224 AromaticContact CE2-NE2 3.2Å; Y220-H224 WeakPolarHBondContact CE2-NE2 3.26Å; Y220-H224 AromaticContact CZ-CD2 3.91Å; Y220-H224 PolarHBondContact O-CD2 3.21Å; H224-H226 VanDerWaalsContact C-N 3.26Å; H224-H226 PolarHBondContact O-N 3.15Å; H224-T227 PolarHBondContact O-N 3Å; H224-T227 VanDerWaalsContact O-N 3.15Å; H224-E228 PolarHBondContact O-N 2.67Å
225T55.8Low70Confident59 Ų5992.4 Ų92.436%0.36247%0.47SS..Hα-helixtrans-61.4-32.8176.41.70000113.3I221 W222 K229I221-T225 PolarHBondContact O-OG1 3.42Å; W222-T225 WeakPolarHBondContact CA-OG1 3.17Å; W222-T225 PolarHBondContact O-N 2.78Å; W222-T225 PolarHBondContact O-OG1 3.37Å; T225-K229 WeakPolarHBondContact O-CG 3.45Å; T225-K229 PolarHBondContact O-N 3.21Å
226H51.2Low68.5Low125 Ų12595.6 Ų95.658%0.57949%0.487SS*.Hα-helixtrans-73.2-37.8175.5-84.7-60000112W222 D223 H224 K229 V230W222-H226 PolarHBondContact O-N 3.46Å; D223-H226 PolarHBondContact O-N 3.34Å; H224-H226 VanDerWaalsContact C-N 3.26Å; H224-H226 PolarHBondContact O-N 3.15Å; H226-K229 PolarHBondContact O-N 3.21Å; H226-V230 VanDerWaalsContact O-CG2 3.28Å; H226-V230 WeakPolarHBondContact O-CG2 3.4Å; H226-V230 PolarHBondContact O-N 3.13Å; H226-V230 VanDerWaalsContact O-N 3.15Å
227T50.4Low66.9Low73 Ų7395.4 Ų95.445%0.44849%0.486SS..Hα-helixtrans-71.7-32.8-178.4-40.30000112.4D223 H224 K231D223-T227 PolarHBondContact O-N 3.45Å; D223-T227 PolarHBondContact O-OG1 3.3Å; H224-T227 PolarHBondContact O-N 3Å; H224-T227 VanDerWaalsContact O-N 3.15Å; T227-K231 WeakPolarHBondContact O-CG 3.43Å; T227-K231 PolarHBondContact O-N 3.18Å
228E50.1Low65.1Low145 Ų14597.8 Ų97.868%0.67850%0.497SS*.Hα-helixtrans-73.8-37.6174.5-71.7-174.4162.400112.8H224 K231 G232H224-E228 PolarHBondContact O-N 2.67Å; E228-K231 PolarHBondContact O-N 3.37Å; E228-G232 PolarHBondContact O-N 2.92Å
229K49.8Very low63.2Low146 Ų146103.9 Ų103.964%0.63553%0.528SS*.Hα-helixtrans-63.9-39.6174.4-77.9-178177.6-177.20112.4T225 H226 K231 G232T225-K229 WeakPolarHBondContact O-CG 3.45Å; T225-K229 PolarHBondContact O-N 3.21Å; H226-K229 PolarHBondContact O-N 3.21Å; K229-K231 VanDerWaalsContact C-N 3.32Å; K229-K231 PolarHBondContact O-N 3.17Å; K229-G232 PolarHBondContact O-N 3.45Å
230V51.6Low61.1Low106 Ų106110 Ų11064%0.64255%0.553SS**Hα-helixtrans-72-23179.1172.80000113H226H226-V230 VanDerWaalsContact O-CG2 3.28Å; H226-V230 WeakPolarHBondContact O-CG2 3.4Å; H226-V230 PolarHBondContact O-N 3.13Å; H226-V230 VanDerWaalsContact O-N 3.15Å
231K47.3Very low58.7Low177 Ų177107.5 Ų107.577%0.7755%0.552SS**Hα-helixtrans-90.6-8.9176-74.4-177.3177.7-178.20113.9T227 E228 K229T227-K231 WeakPolarHBondContact O-CG 3.43Å; T227-K231 PolarHBondContact O-N 3.18Å; E228-K231 PolarHBondContact O-N 3.37Å; K229-K231 VanDerWaalsContact C-N 3.32Å; K229-K231 PolarHBondContact O-N 3.17Å
232G47.1Very low56.1Low71 Ų71115.4 Ų115.473%0.73259%0.593SS**  trans-105.2-0.6-179.500000114.7E228 K229E228-G232 PolarHBondContact O-N 2.92Å; K229-G232 PolarHBondContact O-N 3.45Å
233E42.7Very low53.1Low227 Ų227120.4 Ų120.4100%1.06163%0.626SS**  trans-99.90165.8-70.5-179.917200109.8

Retrieved 233 of 233 residues in 597.6 ms (Link to these results)

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